@article{AwadConradKochetal.2010,
  author    = {Awad, Duha Jawad and Conrad, Franziska and Koch, Andreas and Schilde, Uwe and Poeppl, Andreas and Strauch, Peter},
  title     = {1,10-phenanthroline-dithiolate mixed ligand transition metal complexes : synthesis, characterization and EPR spectroscopy},
  issn      = {0020-1693},
  doi       = {10.1016/j.ica.2010.01.021},
  year      = {2010},
  abstract  = {A series of new N2S2 mixed ligand transition metal complexes, where N-2 is phenanthroline and S-2 is 1,2- dithiooxalate (dto) or 1,2-dithiosquarate (dtsq), has been synthesized and characterized. IR spectra reveal that the 1,2- dithiolate ligands are coordinated via the sulfur atoms forming a N2S2 coordination sphere. The copper(II) complex [Cu(phen)(dto)] was studied by EPR spectroscopy as a diamagnetically diluted powder. The diamagnetic dilution resulted from doping of the copper complex into the isostructural host lattice of the nickel complex [Ni(phen)(dto)]. The electronic situation in the frontier orbitals of the copper complex calculated from the experimental data is compared to the results of EHT and DFT calculations. Furthermore, one side product, chlorobis(1,10-phenanthroline)copper(I) ethanol solvate hydrate [(phen)(2)CuCl]center dot C2H5OH center dot H2O, was formed by a reduction process and characterized by X-ray diffraction. In the crystal packing one-dimensional columns of dimers are formed, stabilized by significant pi-pi interactions.},
  language  = {en}
}
@article{KammerStarkePietruchaetal.2012,
  author    = {Kammer, Stefan and Starke, Ines and Pietrucha, Andreas and Kelling, Alexandra and Mickler, Wulfhard and Schilde, Uwe and Dosche, Carsten and Kleinpeter, Erich and Holdt, Hans-J{\"u}rgen},
  title     = {1,12-Diazaperylene and 2,11-dialkylated-1,12-diazaperylene iridium(III) complexes [Ir((CN)-N-boolean AND)(2)((NN)-N-boolean AND)]PF6: new supramolecular assemblies},
  series = {Dalton transactions : a journal of inorganic chemistry, including bioinorganic, organometallic, and solid-state chemistry},
  volume    = {41},
  journal   = {Dalton transactions : a journal of inorganic chemistry, including bioinorganic, organometallic, and solid-state chemistry},
  number    = {34},
  publisher = {Royal Society of Chemistry},
  address   = {Cambridge},
  issn      = {1477-9226},
  doi       = {10.1039/c2dt30412k},
  pages     = {10219 -- 10227},
  year      = {2012},
  abstract  = {A series of new monocationic iridium(III) complexes [Ir((CN)-N-boolean AND)(2)((NN)-N-boolean AND)]PF6 with "large-surface" alpha,alpha'-diimin ligands (NN)-N-boolean AND (dap = 1,12-diazaperylene, dmedap = 2,11-dimethyl-1,12-diazaperylene, dipdap = 2,11-diisopropyl-1,12-diazaperylene) and different cyclometalating ligands (CN)-N-boolean AND (piq = 1-phenylisoquinoline, bzq = benzo[h]quinoline, ppz = 1-phenylpyrazole, thpy = 2-(2-thienyl)pyridine, ppy = 2-phenylpyridine, meppy = 2-(4-methylphenyl)pyridine, dfppy = 2-(2,4-difluorophenyl)pyridine) were synthesized. The solid structures of the complexes [Ir(piq)(2)(dap)]PF6, [Ir(bzq)(2)(dap)]PF6, [Ir(ppy)(2)(dipdap)]PF6, [Ir(piq)(2)(dmedap)]PF6, [Ir(ppy)(2)(dap)]PF6 and [Ir(ppz)(2)(dap)]PF6 are reported. In [Ir(piq)(2)(dap)]PF6, the dap ligand and one of the piq ligands of each cationic complex are involved in pi-pi stacking interactions forming supramolecular channels running along the crystallographic c axis. In the crystalline [Ir(bzq)(2)(dap)]PF6 pi-pi stacking interactions between the metal complexes lead to the formation of a 2D layer structure. In addition, CH-pi interactions were found in all compounds, which are what stabilizes the solid structure. In particular, a significant number of them were found in [Ir(piq)(2)(dap)]PF6 and [Ir(bzq)(2)(dap)]PF6. The crystal structures of [Ir(ppy)(2)(dipdap)]PF6 and [Ir(ppy)(2)(dmedap)]PF6 are also presented, being the first examples of bis-cyclometalated iridium(III) complexes with phenanthroline-type alpha,alpha'-diimin ligands bearing bulky alkyl groups in the neighbourhood of the N-donor atoms. These ligands implicate a distorted octahedral coordination geometry that in turn destabilized the Ir-N-N boolean AND N bonds. The new iridium (III) complexes are not luminescent. All compounds show an electrochemically irreversible anodic peak between 1.15 and 1.58 V, which is influenced by the different cyclometalated ligands. All of the new complexes show two reversible successive one-electron "large-surface" ligand-centred reductions around -0.70 V and -1.30 V. Electrospray ionisation mass spectrometry (ESI-MS) and collision induced decomposition (CID) measurements were used to investigate the stability of the new complexes. Thereby, the stability agreed well with the order of the Ir-N-N boolean AND N bond lengths.},
  language  = {en}
}
@article{WenzelWehseSchildeetal.2004,
  author    = {Wenzel, Barbara and Wehse, Burkhard and Schilde, Uwe and Strauch, Peter},
  title     = {1,2-Dithioquadratato- und 1,2-Dithiooxalatoindate(III) = 1,2-dithiosquarato- and 1,2-dithiooxalatoindates(III)},
  year      = {2004},
  abstract  = {Indium(III) chloride forms in water with potassium 1,2-dithiooxalate (dto) and potassium 1,2-dithiosquarate (dtsq) stable coordination compounds. Due to the higher bridging ability of the 1,2-dithiooxalate ligand in all cases only thiooxalate bridged binuclear complexes were found. From 1,2-dithioquadratate with an identical donor atom set mononuclear trischelates could be isolated. Five crystalline complexes, (BzlMe(3)N)(4)[(dto)(2)In(dto)In(dto)(2)] (1), (BzlPh(3)P)(4)[(dto)(2)In(dto)In(dto)(2)] (2), (BzlMe(3)N)(3)[In(dtsq)(3)] (3), (Bu4N)(3)[In(dtsq)(3)] (4) and (Ph4P)[In(dtsq)(2)(DMF)(2)] (5), have been isolated and characterized by X-ray analyses. Due to the type of the complex and the cations involved these compounds crystallize in different space groups with the following parameters: 1, monoclinic in P2(1)/c with a = 14.4035(5) Angstrom, b = 10.8141(5) Angstrom, c = 23.3698(9) Angstrom, beta = 124.664(2)degrees, and Z = 2; 2, triclinic in P (1) over bar with a = 11.3872(7) Angstrom, b = 13.6669(9) Angstrom, c = 17.4296(10) Angstrom, alpha = 88.883(5)degrees, beta = 96.763(1)degrees, gamma = 74.587(5)degrees, and Z = 1; 3, hexagonal in R3 with a = 20.6501(16) Angstrom, b = 20.6501(16) Angstrom, c = 19.0706(13) Angstrom and Z = 6; 4, monoclinic in P21/c with a = 22.7650(15) Angstrom, b = 20.4656(10) Angstrom, c = 14.4770(9) Angstrom, P},
  language  = {de}
}
@article{PoleschnerHeydenreichSchilde2000,
  author    = {Poleschner, Helmut and Heydenreich, Matthias and Schilde, Uwe},
  title     = {13C, 19F and 77Se NMR study of vicinal (E)-fluoro(organylseleno)olefins and [(E)- fluoroalkenyl]diorganylselenonium salts},
  year      = {2000},
  abstract  = {Selenides of the type R1Se-EMe3 (E = Si, Ge, Sn, Pb) react with xenon difluoride by cleavage of the Se-E bond to yield the R1Se-F intermediate and the fluorides Me3E-F, whereas the Se-C bond in PhSe-tBu (E = C) is stable against XeF2. The presence of R1Se-F intermediates is confirmed by addition to acetylenes (4-octyne, 3-hexyne). Thus, the fluoroselenenylation of acetylenes gives fluoro(organylseleno)olefins in preparative yields. In the cases of E = Si, Ge, Sn, and Pb, aryl and n-alkyl groups are suitable as the substituent R1. The X-ray crystal structural analysis of (E)-3- (p-carboxyphenylseleno)-4-fluorohex-3-ene - the first example of an uncharged fluoroselenoolefin synthesized from p- EtO2C-C6H4-Se-SnMe3, XeF2, and 3-hexyne followed by an ester hydrolysis - shows that the addition of the selenenylfluoride intermediate to the acetylene proceeds via a trans-addition, as is known for the R2Se2-XeF2 reagents.},
  language  = {en}
}
@article{AwadSchildeStrauch2011,
  author    = {Awad, Duha Jawad and Schilde, Uwe and Strauch, Peter},
  title     = {4,4 '-Bis(tert-butyl)-2,2 '-bipyridinedichlorometal(II) - Synthesis, structure and EPR spectroscopy},
  series = {Inorganica chimica acta : the international inorganic chemistry journal},
  volume    = {365},
  journal   = {Inorganica chimica acta : the international inorganic chemistry journal},
  number    = {1},
  publisher = {Elsevier},
  address   = {Lausanne},
  issn      = {0020-1693},
  doi       = {10.1016/j.ica.2010.08.035},
  pages     = {127 -- 132},
  year      = {2011},
  abstract  = {Due to the better solubility of the 4,4'-substituted bipyridine ligand a series of 4,4'0-bis(tert-butyl)-2,2'-bipyridinedichlorometal(II) complexes, [M(tbbpy)Cl(2)], with M = Cu, Ni, Zn, Pd, Pt was synthesised and characterised. The blue copper complex 4,4'-bis(tert-butyl)-2,2'-bipyridinedichlorocopper(II) was isolated in two different polymorphic forms, as prisms 1 with a solvent inclusion and solvent-free as needles 2. Both structures were determined by X-ray structure analysis. They crystallise in the monoclinic space group P2(1)/c with four molecules in the unit cell, but with different unit cells and packing motifs. Whereas in the prisms 1, with the unit cell parameters a = 12.1613(12), b = 10.6363(7), c = 16.3074(15) angstrom, eta = 94.446(8)degrees, the packing is dominated by intra-and intermolecular hydrogen bonds, in the needles 2, with a = 7.738(1), b = 18. 333(2), c = 13.291(3) angstrom, beta = 97.512(15)degrees, only intramolecular hydrogen bonds appear and the complex molecules are arranged in columns which are stabilised by p-p-stacking interactions. In both complexes the copper has a tetrahedrally distorted coordination sphere. These copper complexes were also studied by EPR spectroscopy in solution, as frozen glass and diamagnetically diluted powder with the analogue [Pd(tbbpy)Cl(2)] as host lattice.},
  language  = {en}
}
@article{ZehmFudickarHansetal.2008,
  author    = {Zehm, Daniel and Fudickar, Werner and Hans, Melanie and Schilde, Uwe and Kelling, Alexandra and Linker, Torsten},
  title     = {9,10-Diarylanthracenes as molecular switches : syntheses, properties, isomerisations and their reactions with singlet oxygen},
  issn      = {0947-6539},
  year      = {2008},
  abstract  = {A series of 9,10-diarylanthracenes with various substituents at the ortho positions have been synthesised by palladium-catalysed cross-coupling reactions. Such compounds exhibit interesting physical properties and can be applied as molecular switches. Despite the high steric demand of the substituents, products were formed in moderate-to-good yields. In some cases, microwave conditions further improved yields. Bis-coupling afforded two isomers (syn and anti) that do not interconvert at room temperature. These products were easily separated and their relative stereochemistries were unequivocally assigned by NMR spectroscopy and X-ray analysis. The syn and anti isomers exhibit different physical properties (e.g., melting points and solubilities) and interconversion by rotation around the aryl-aryl axis commences at <100 °C for fluoro-substituted diarylanthracenes and at >300 °C for alkyl- or alkoxy-substituted diarylanthracenes. The reactions with singlet oxygen were studied separately and revealed different reactivities and reaction pathways. The yields and reactivities depend on the size and electronic nature of the substituents. The anti isomers form the same 9,10-endoperoxides as the syn species, occasionally accompanied by unexpected 1,4-endoperoxides as byproducts. Thermolysis of the endoperoxides exclusively yielded the syn isomers. The interesting rotation around the aryl-aryl axis allows the application of 9,10-diarylanthracenes as molecular switches, which are triggered by light and air under mild conditions. Finally, the oxygenation and thermolysis sequence provides a simple, synthetic access to a single stereoisomer (syn) from an unselective coupling step.},
  language  = {en}
}
@article{SchmidtStaudeKellingetal.2011,
  author    = {Schmidt, Bernd and Staude, Lucia and Kelling, Alexandra and Schilde, Uwe},
  title     = {A Cross-Metathesis-Conjugate addition route to enantiopure gamma-Butyrolactams and gamma-Lactones from a C-2-Symmetric Precursor},
  series = {European journal of organic chemistry},
  journal   = {European journal of organic chemistry},
  number    = {9},
  publisher = {Wiley-Blackwell},
  address   = {Malden},
  issn      = {1434-193X},
  doi       = {10.1002/ejoc.201001528},
  pages     = {1721 -- 1727},
  year      = {2011},
  abstract  = {A protected derivative of (3R, 4R)-hexa-1,5-diene-3,4-diol, a conveniently accessible C-2-symmetric building block, undergoes single or double cross metathesis with methyl acryl-ate. The cross metathesis products are amenable to stereoselective conjugate addition reactions and can be converted into either gamma-butyrolactones or gamma-lactams.},
  language  = {en}
}
@article{WessigWawrzinekMoellnitzetal.2011,
  author    = {Wessig, Pablo and Wawrzinek, Robert and Moellnitz, Kristian and Feldbusch, Elvira and Schilde, Uwe},
  title     = {A new class of fluorescent dyes based on 1,3-benzodioxole and [1,3]-dioxolo[4.5-f]benzodioxole},
  series = {Tetrahedron letters},
  volume    = {52},
  journal   = {Tetrahedron letters},
  number    = {46},
  publisher = {Elsevier},
  address   = {Oxford},
  issn      = {0040-4039},
  doi       = {10.1016/j.tetlet.2011.09.058},
  pages     = {6192 -- 6195},
  year      = {2011},
  abstract  = {We report on synthesis and photophysical properties of a new class of fluorescent dyes. They are characterized by large Stokes-shifts, long fluorescence lifetimes in organic solvents and a pronounced dependency of the fluorescence lifetime on the solvent polarity. Also worthy of note is the high bleaching stability. To provide access to biochemical and medical applications a series of derivatives were prepared, which exhibit specific reactivity towards different biologically relevant functional groups (carboxylic acids, amines, maleimides, N-hydroxysuccinimide esters). Furthermore, two alkynes were prepared, which could be used in 'Click' chemistry.},
  language  = {en}
}
@article{MondalBhuniaKellingetal.2014,
  author    = {Mondal, Suvendu Sekhar and Bhunia, Asamanjoy and Kelling, Alexandra and Schilde, Uwe and Janiak, Christoph and Holdt, Hans-J{\"u}rgen},
  title     = {A supramolecular Co(II)(14)- metal-organic cube in a hydrogen-bonded network and a Co(II)-organic framework with a flexible methoxy substituent},
  series = {Chemical communications},
  volume    = {50},
  journal   = {Chemical communications},
  number    = {41},
  publisher = {Royal Society of Chemistry},
  address   = {Cambridge},
  issn      = {1359-7345},
  doi       = {10.1039/c3cc49698h},
  pages     = {5441 -- 5443},
  year      = {2014},
  abstract  = {The reaction of 4,5-dicyano-2-methoxyimidazole (L1) with Co(NO3)(2.) 6H(2)O under solvothermal conditions in DMF, a MOF, IFP-8 and a hydrogen-bonded network consisting of tetradecanuclear Co(II)(14)-metal organic cube (1) are achieved. 1 shows the bcu net with 14 cobalt atoms.},
  language  = {en}
}
@article{GroboschSchildeTiersch2006,
  author    = {Grobosch, Thomas and Schilde, Uwe and Tiersch, Brigitte},
  title     = {Abtrennung von Arsen und anderer Schwermetalle mit impr{\"a}gnierten Adsorberpolymeren - teil 2: Abtrennung von Blei, Kupfer, Nickel und Zink},
  issn      = {0009-286X},
  doi       = {10.1002/cite.200500171},
  year      = {2006},
  language  = {de}
}
@article{UhlemannGroboschSchildeetal.1996,
  author    = {Uhlemann, Erhard and Grobosch, Thomas and Schilde, Uwe and Feistel, Lothar},
  title     = {Abtrennung von Arsen(V) aus Grundwasser mittels Ionenaustauscher},
  year      = {1996},
  language  = {de}
}
@article{MuellerKellingSchildeetal.2009,
  author    = {M{\"u}ller, Holger and Kelling, Alexandra and Schilde, Uwe and Holdt, Hans-J{\"u}rgen},
  title     = {Ag(I)-, Hg(II)- und Pt(II)-Komplexe von Maleonitril-thiakronenethern},
  issn      = {0932-0776},
  year      = {2009},
  abstract  = {The synthesis and single crystal X-ray structures of eight AgI, HgII, and PtII complexes with the thiacrown ethers maleonitrile-tetrathia-12-crown-4 (mn12S4), maleonitrile-tetrathia-13-crown-4 (mn13S4), and maleonitrile- pentathia-15-crown-5 (mn15S5) (1) are reported. The ligand mn15S5 was synthesized for the first time and characterized by X-ray diffraction. With silver(I) perchlorate and silver(I) tetrafluoroborate it forms the chiral complexes [Ag(mn15S5)]ClO4·CH3NO2 (2) and [Ag(mn15S5)]BF4·CH3NO2·0.25H2O (3) with half-sandwich moieties. AgI is located in a distorted tetrahedral coordination environment, involving three sulfur atoms of the crown cycle and a fourth one of the adjacent half-sandwich moiety, forming a helical structure. The reaction of Hg(ClO4)2 with mn13S4 yielded the dinuclear complex [Hg2(mn13S4)3](ClO4)4 (4) containing two half-sandwich moieties with a third ligand molecule as a bridging unit. Mercury(II) chloride and mercury(II) iodide react with mn12S4 and mn13S4 to form complexes of the general composition [HgX2(L)] (X = Cl, I; L = mn12S4, mn13S4): [HgCl2(mn12S4)] (5), [HgI2(mn12S4)] (6), [HgCl2(mn13S4)] (7) or [HgX2(L)2] (X = I; L = mn13S4): [HgI2(mn13S4)2] (8). Only one or two sulfur atoms of the ligand are involved in the complexation, and chain or ribbon structures are formed. In these compounds the HgX2 units (X = Cl, I) are preserved, coordinated by sulfur atoms of bridging mn12S4 or mn13S4 ligands. In all complexes of this type, the metal atoms are not coordinated inside the cavity, but in an exocyclic mode, because the diameter of the macrocycle is too small. Additionally, the PtCl2 complex of mn12S4 was investigated, where PtII is coordinated in an exocyclic mode forming the complex [PtCl2(mn12S4)] (9). Two of the four sulfur atoms of the macrocycle are bonded to the metal giving together with both chlorine atoms a square-planar coordination geometry. Together with a long-range interaction with a further sulfur atom of the macrocycle a square-pyramidal coordination environment is formed.},
  language  = {de}
}
@article{AbouserieZehbeMetzneretal.2017,
  author    = {Abouserie, Ahed and Zehbe, Kerstin and Metzner, Philipp and Kelling, Alexandra and G{\"u}nter, Christina and Schilde, Uwe and Strauch, Peter and K{\"o}rzd{\"o}rfer, Thomas and Taubert, Andreas},
  title     = {Alkylpyridinium Tetrahalidometallate Ionic Liquids and Ionic Liquid Crystals: Insights into the Origin of Their Phase Behavior},
  series = {European journal of inorganic chemistry : a journal of ChemPubSoc Europe},
  journal   = {European journal of inorganic chemistry : a journal of ChemPubSoc Europe},
  publisher = {Wiley-VCH},
  address   = {Weinheim},
  issn      = {1434-1948},
  doi       = {10.1002/ejic.201700826},
  pages     = {5640 -- 5649},
  year      = {2017},
  abstract  = {Six N-alkylpyridinium salts [CnPy](2)[MCl4] (n = 4 or 12 and M = Co, Cu, Zn) were synthesized, and their structure and thermal properties were studied. The [C4Py](2)[MCl4] compounds are monoclinic and crystallize in the space group P2(1)/n. The crystals of the longer chain analogues [C12Py](2)[MCl4] are triclinic and crystallize in the space group P (1) over bar. Above the melting temperature, all compounds are ionic liquids (ILs). The derivatives with the longer C12 chain exhibit liquid crystallinity and the shorter chain compounds only show a melting transition. Consistent with single-crystal analysis, electron paramagnetic resonance spectroscopy suggests that the [CuCl4](2-) ions in the Cu-based ILs have a distorted tetrahedral geometry.},
  language  = {en}
}
@article{AbouserieZehbeMetzneretal.2017,
  author    = {Abouserie, Ahed and Zehbe, Kerstin and Metzner, Philipp and Kelling, Alexandra and G{\"u}nter, Christina and Schilde, Uwe and Strauch, Peter and K{\"o}rzd{\"o}rfer, Thomas and Taubert, Andreas},
  title     = {Alkylpyridinium Tetrahalidometallate Ionic Liquids and Ionic Liquid Crystals: Insights into the Origin of Their Phase Behavior},
  series = {European journal of inorganic chemistry : a journal of ChemPubSoc Europe},
  journal   = {European journal of inorganic chemistry : a journal of ChemPubSoc Europe},
  publisher = {Wiley-VCH},
  address   = {Weinheim},
  issn      = {1434-1948},
  doi       = {10.1002/ejic.201700826},
  pages     = {5640 -- 5649},
  year      = {2017},
  abstract  = {Six N-alkylpyridinium salts [CnPy](2)[MCl4] (n = 4 or 12 and M = Co, Cu, Zn) were synthesized, and their structure and thermal properties were studied. The [C4Py](2)[MCl4] compounds are monoclinic and crystallize in the space group P2(1)/n. The crystals of the longer chain analogues [C12Py](2)[MCl4] are triclinic and crystallize in the space group P (1) over bar. Above the melting temperature, all compounds are ionic liquids (ILs). The derivatives with the longer C12 chain exhibit liquid crystallinity and the shorter chain compounds only show a melting transition. Consistent with single-crystal analysis, electron paramagnetic resonance spectroscopy suggests that the [CuCl4](2-) ions in the Cu-based ILs have a distorted tetrahedral geometry.},
  language  = {en}
}
@article{SteeplesKellingSchildeetal.2016,
  author    = {Steeples, Elliot and Kelling, Alexandra and Schilde, Uwe and Esposito, Davide},
  title     = {Amino acid-derived N-heterocyclic carbene palladium complexes for aqueous phase Suzuki-Miyaura couplings},
  series = {New journal of chemistry},
  volume    = {40},
  journal   = {New journal of chemistry},
  publisher = {Royal Society of Chemistry},
  address   = {Cambridge},
  issn      = {1144-0546},
  doi       = {10.1039/c5nj03337c},
  pages     = {4922 -- 4930},
  year      = {2016},
  abstract  = {In this work, three ligands produced from amino acids were synthesized and used to produce five bis- and PEPPSI-type palladium-NHC complexes using a novel synthesis route from sustainable starting materials. Three of these complexes were used as precatalysts in the aqueous-phase Suzuki-Miyaura coupling of various substrates displaying high activity. TEM and mercury poisoning experiments provide evidence for Pd-nanoparticle formation stabilized in water.},
  language  = {en}
}
@article{MoskalikAstakhovaSchildeetal.2014,
  author    = {Moskalik, Mikhail Yu. and Astakhova, Vera V. and Schilde, Uwe and Sterkhova, Irina V. and Shainyan, Bagrat A.},
  title     = {Assembling of 3,6-diazabicyclo[3.1.0]hexane framework in oxidative triflamidation of substituted buta-1,3-dienes},
  series = {Tetrahedron},
  volume    = {70},
  journal   = {Tetrahedron},
  number    = {45},
  publisher = {Elsevier},
  address   = {Oxford},
  issn      = {0040-4020},
  doi       = {10.1016/j.tet.2014.09.050},
  pages     = {8636 -- 8641},
  year      = {2014},
  language  = {en}
}
@article{WessigMatthesSchildeetal.2013,
  author    = {Wessig, Pablo and Matthes, Annika and Schilde, Uwe and Kelling, Alexandra},
  title     = {Asymmetric synthesis of (1,5)Naphthalenophanes by Dehydro-Diels-Alder reaction},
  series = {European journal of organic chemistry},
  journal   = {European journal of organic chemistry},
  number    = {11},
  publisher = {Wiley-VCH},
  address   = {Weinheim},
  issn      = {1434-193X},
  doi       = {10.1002/ejoc.201201594},
  pages     = {2123 -- 2129},
  year      = {2013},
  abstract  = {An asymmetric variant of the dehydro-Diels-Alder (DDA) reaction has been developed and applied in the atropselective synthesis of various (1,5)naphthalenophanes. Whereas the suitability of the photochemically induced DDA (PDDA) was limited, the thermally induced DDA provided the desired product, depending on the chiral auxiliary used and the length of the linker, with nearly perfect stereoselectivity. Furthermore, the mechanism of the DDA was investigated by means of DFT calculations, and a stepwise mechanism involving 1,4-biradicals was suggested.},
  language  = {en}
}
@article{StrauchNeumannKellingetal.2015,
  author    = {Strauch, Peter and Neumann, Mike and Kelling, Alexandra and Schilde, Uwe},
  title     = {Bis(1,2-dithiosquarato)nickelates(II): Synthesis, Structure, EPR and Thermal Behavior},
  series = {Acta chimica Slovenica},
  volume    = {62},
  journal   = {Acta chimica Slovenica},
  number    = {2},
  publisher = {Drustvo},
  address   = {Ljubljana},
  issn      = {1318-0207},
  pages     = {288 -- 296},
  year      = {2015},
  abstract  = {1,2-Dithiosquaratonickelates are available by direct synthesis from metal salts with dipotassium-1,2-dithiosquarate and the appropriate counter cations. The synthesis and characterization, including mass spectrometry, of a series 1,2-dithiosquaratonickelates(II), [Ni(dtsq)(2)](2-), with several "onium" cations is reported and the X-ray structures of two diamagnetic complexes, (HexPh(3)P)(2)[Ni(dtsq)(2)] and (BuPh3P)(2)[Ni(dtsq)(2)] with sterically demanding counter ions are presented. The diamagnetic nickel complexes have been doped as host lattices with traces of Cu(II) to measure EPR for additional structural information. The thermal behavior of this series is studied by thermogravimetry and differential thermal analysis (TG/DTA). The thermolysis in air as well as under nitrogen atmosphere of these complexes results in nickel oxide nano-particles in all cases, which are characterized by X-ray powder diffraction.},
  language  = {en}
}
@article{UhlemannSchildeWeller1995,
  author    = {Uhlemann, Erhard and Schilde, Uwe and Weller, Frank},
  title     = {Calcium- und Bariumkomplexe mit 1-Phenyl-3-methyl-4-benzoyl-pyrazol-5-on},
  year      = {1995},
  language  = {de}
}
@article{SchmidtRiemerSchilde2014,
  author    = {Schmidt, Bernd and Riemer, Martin and Schilde, Uwe},
  title     = {Chroman-4-ones via microwave-promoted domino claisen rearrangement-oxa-michael addition: Synthesis of tabchromones A and B},
  series = {Synlett : accounts and rapid communications in synthetic organic chemistry},
  volume    = {25},
  journal   = {Synlett : accounts and rapid communications in synthetic organic chemistry},
  number    = {20},
  publisher = {Thieme},
  address   = {Stuttgart},
  issn      = {0936-5214},
  doi       = {10.1055/s-0034-1379364},
  pages     = {2943 -- 2946},
  year      = {2014},
  abstract  = {Allyl phenyl ethers with a pendant enone substituent undergo, upon microwave irradiation, a domino sequence of Claisen rearrangement and 6-endo-trig-cyclization to furnish functionalized chroman-4-ones. The natural products tabchromones A and B were synthesized via this method.},
  language  = {en}
}
@article{CoyBarreraCucaSuarezSefkowetal.2012,
  author    = {Coy-Barrera, Ericsson D. and Cuca-Suarez, Luis E. and Sefkow, Michael and Schilde, Uwe},
  title     = {Cinerin C: a macrophyllin-type bicyclo[3.2.1]octane neolignan from Pleurothyrium cinereum (Lauraceae)},
  series = {Acta crystallographica : Section C, Crystal structure communications},
  volume    = {68},
  journal   = {Acta crystallographica : Section C, Crystal structure communications},
  number    = {2},
  publisher = {Wiley-Blackwell},
  address   = {Hoboken},
  issn      = {0108-2701},
  doi       = {10.1107/S0108270112030946},
  pages     = {O320 -- +},
  year      = {2012},
  abstract  = {The structure of naturally-occurring cinerin C [systematic name: (7S,8R,3'R,4'S,5'R)-Delta(8')-4'-hydroxy-5,5',3'-trimethoxy-3,4-methylenedioxy-2',3',4',5'-tetrahydro-2'-oxo-7.3',8.5'-neolignan], isolated from the ethanol extract of leaves of Pleurothyrium cinereum (Lauraceae), has previously been established by NMR and HRMS spectroscopy, and its absolute configuration established by circular dichroism measurements. For the first time, its crystal strucure has now been established by single-crystal X-ray analysis, as the monohydrate, C22H26O7 center dot H2O. The bicyclooctane moiety comprises fused cyclopentane and cyclohexenone rings which are almost coplanar. An intermolecular O-H center dot center dot center dot O hydrogen bond links the 4'-OH and 5'-OCH3 groups along the c axis.},
  language  = {en}
}
@article{StarkeKammerGrunwaldetal.2008,
  author    = {Starke, Ines and Kammer, Stefan and Grunwald, Nicolas and Schilde, Uwe and Holdt, Hans-J{\"u}rgen and Kleinpeter, Erich},
  title     = {Complexation of diazaperylene and bisisoquinoline with transition metal ions in the gas phase studied by electrospray ionization mass spectrometry},
  year      = {2008},
  abstract  = {The complex formation of the ligands 1,12-diazaperylene (dap), 1,1-bisisoquinoline (bis), 2,2-bipyridine (bpy) and 1,10-phenanthroline (phen) with transition metal ions (M = Fe, Co, Ni, Cu, Zn, Ru, Os, Re, Pd, Pt, Ag and Cd) in the gas phase has been studied by electrospray ionization mass spectrometry. With the exception of Ru, Os, Fe, Ni and Cu, singly charged complexes [MLn]+ (n = 1,2) were observed. The complexes of dap and bis with Ru, Os, Fe and Ni ions, and the mixed ligand complexes with bpy and phen, are preferably of the doubly charged type [ML3]2+. In addition, collision- induced dissociation (CID) measurements were employed to evaluate the relative stabilities of these complexes. The CID experiments of mixed-ligand complexes which contain both dap and phen or dap and bpy exhibit preferential elimination of bpy, indicating that bpy is a weaker ligand than phen and dap.},
  language  = {en}
}
@article{RathAnandSankaretal.2003,
  author    = {Rath, Harapriya and Anand, V. G. and Sankar, J. and Venkatraman, S. and Chandrashekar, T. K. and Joshi, Bhawani S. and Khetrapal, C. L. and Schilde, Uwe and Senge, Mathias O.},
  title     = {Core-Modified Hexaphyrins; Characterization of Two- and Four-Ring Inverted 26 {\^o} Aromatic Macrocycles},
  year      = {2003},
  language  = {en}
}
@article{UhlemannSchildeHefeleetal.1994,
  author    = {Uhlemann, Erhard and Schilde, Uwe and Hefele, Heike and Ludwig, Eberhard},
  title     = {Crystal and molecular structure of 2,2'-dihydroxyazobenzene},
  issn      = {0023-4753},
  year      = {1994},
  language  = {en}
}
@article{PeikowMaternPeteretal.2005,
  author    = {Peikow, Dirk and Matern, Christa-Maria and Peter, Martin G. and Schilde, Uwe},
  title     = {Crystal structure of (1,4,7,10,13-pentaoxacyclopentadecane-O,O ',O '',O ''')(trifluoromethanesulfonato-O,O ')sodium, Na(C10H20O5)(CF3SO3)},
  year      = {2005},
  abstract  = {C11H20F3NaO8S, monoclinic, P121/nil (no. 11), a = 7.947(1) angstrom, b = 12.056(1) angstrom, c = 9.083(1) angstrom, P = 106.01 (1)degrees, V = 836.4 angstrom(3), Z = 2, R-gt(F) = 0.043, wR(ref)(F-2) = 0.120, T = 210 K.},
  language  = {en}
}
@article{WessigMoellnitzKellingetal.2011,
  author    = {Wessig, Pablo and M{\"o}llnitz, Kristian and Kelling, Alexandra and Schilde, Uwe},
  title     = {Crystal structure of 1r,2c,3c,4t,5t,6t-1,2,3,4,5,6-hexakis-trimethylsilanyloxy-cyclohexane, C24H60O6Si6},
  series = {Zeitschrift f{\"u}r Kristallographie : international journal for structural, physical and chemical aspects of crystalline materials ; New crystal structures},
  volume    = {226},
  journal   = {Zeitschrift f{\"u}r Kristallographie : international journal for structural, physical and chemical aspects of crystalline materials ; New crystal structures},
  number    = {2},
  publisher = {De Gruyter Oldenbourg},
  address   = {M{\"u}nchen},
  issn      = {1433-7266},
  doi       = {10.1524/ncrs.2011.0105},
  pages     = {228 -- 230},
  year      = {2011},
  abstract  = {C24H60O6Si6, triclinic, P (1) over bar (no. 2), a = 11.307(2) angstrom, b = 12.159(2) angstrom, = 16.576(2) angstrom, alpha = 109.47(1)degrees, beta = 94.64(1)degrees, gamma = 111.65(1)degrees, V = 1942.3 angstrom(3), Z = 2, R-gt(F) = 0.043, wR(ref)(F-2) = 0.118, T = 210 K.},
  language  = {en}
}
@article{WessigMatthesSchilde2010,
  author    = {Wessig, Pablo and Matthes, Annika and Schilde, Uwe},
  title     = {Crystal structure of 3,4-diacetyl-15,21-dioxatetracyclo- [23.4.0.02,7.06,11]nonacosa-1(29),2,4,6,8,10,25,27- octaene- 14,22-dione{\`u}water (1:2), C31H32O6 · 2H2O},
  issn      = {1433-7266},
  year      = {2010},
  language  = {en}
}
@article{UhlemannSchildeBansseetal.1995,
  author    = {Uhlemann, Erhard and Schilde, Uwe and Banße, Wolfgang and Ludwig, Eberhard},
  title     = {Crystal structure of bis(1,3-diphenyl-1,3-dionato)oxo-vanadium(IV), C30H2205V},
  issn      = {0044-2968},
  year      = {1995},
  language  = {en}
}
@article{SchildeMicklerUhlemann1997,
  author    = {Schilde, Uwe and Mickler, Wulfhard and Uhlemann, Erhard},
  title     = {Crystal structure of bis(1-phenyl-5-cyclohexyl-pentane-1,3-dionato-copper(II)},
  issn      = {0044-2968},
  year      = {1997},
  language  = {en}
}
@article{UhlemannSchildeMickler1996,
  author    = {Uhlemann, Erhard and Schilde, Uwe and Mickler, Wulfhard},
  title     = {Crystal structure of bis(1-phenyldecane-1,3-dionato)-copper(II), Cu(C16H21O2)2},
  issn      = {0044-2968},
  year      = {1996},
  language  = {en}
}
@article{HahnKellingSchildeetal.2008,
  author    = {Hahn, Simone and Kelling, Alexandra and Schilde, Uwe and Holdt, Hans-J{\"u}rgen},
  title     = {Crystal structure of bis(2-ethylthiomethylpyridine)platinum(II) hexachloroplatinate, [Pt(C8H11NS)2][PtCl6]},
  issn      = {1433-7266},
  doi       = {10.1524/ncrs.2008.0216},
  year      = {2008},
  abstract  = {C16H22Cl6N2Pt2S2, orthorhombic, Pbca (no. 61), a = 15.5660(8) angstrom, b = 17.4892(9) angstrom, c = 18.161 (1) angstrom, V = 4944. 1 angstrom(3), Z = 8, R-gt(F) = 0.030, wR(ref)(F-2) = 0.055, T = 210 K.},
  language  = {en}
}
@article{LinkerFudickarKellingetal.2013,
  author    = {Linker, Torsten and Fudickar, Werner and Kelling, Alexandra and Schilde, Uwe},
  title     = {Crystal structure of dimethyl 1,4-dioxaspiro[4,5]dec-6-ene-(8R)-[(3,5-dinitrobenzoyl)oxa]-(2R,3R)-dica rboxylate, C19H18N2O12},
  series = {Zeitschrift f{\"u}r Kristallographie : international journal for structural, physical and chemical aspects of crystalline materials ; New crystal structures},
  volume    = {228},
  journal   = {Zeitschrift f{\"u}r Kristallographie : international journal for structural, physical and chemical aspects of crystalline materials ; New crystal structures},
  number    = {2},
  publisher = {De Gruyter Oldenbourg},
  address   = {M{\"u}nchen},
  issn      = {1433-7266},
  doi       = {10.1524/ncrs.2013.0123},
  pages     = {241 -- 242},
  year      = {2013},
  abstract  = {C19H18N2O12, orthorhombic, P2(1)2(1)2(1) (no. 19), a = 6.2472(6) angstrom, b = 17.576(2) angstrom, c = 18.848(3) angstrom, V = 2069.6 angstrom(3), Z = 4, R-gt(F) = 0.0393, wR(ref)(F-2) = 0.0694, T = 210 K.},
  language  = {en}
}
@article{SchildePazOrtiz2017,
  author    = {Schilde, Uwe and Paz, Christian and Ortiz, Leandro},
  title     = {Crystal structure of erioflorin isolated from Podanthus mitiqui (L.)},
  series = {Acta Crystallographica Section E : Crystallographic Communications},
  volume    = {73},
  journal   = {Acta Crystallographica Section E : Crystallographic Communications},
  number    = {3},
  publisher = {International Union of Crystallography},
  address   = {Chester},
  doi       = {10.1107/S2056989017001700},
  pages     = {334 -- 337},
  year      = {2017},
  abstract  = {The title compound, erioflorin, C19H24O6 [systematic name: (1aR,3S,4Z,5aR,8aR,9R,10aR)-1a, 2,3,5a, 7,8,8a, 9,10,10a-decahydro-3-hydroxy-4,10a-dimethyl-8-methylidene-7-oxooxireno[5,6] cyclodeca[1,2-b]furan-9-yl methacrylate], is a tricyclic germacrane sesquiterpene lactone, which was isolated from Podanthus mitiqui (L.). The compound crystallizes in the space group P2(1)2(1)2(1), and its molecular structure consists of a methacrylic ester of a ten-membered ring sesquiterpenoid annelated with an epoxide and a butyrolactone. The structure is stabilized by one intramolecular C-H center dot center dot center dot O hydrogen bond. An O-H center dot center dot center dot O hydrogen bond and further C-H center dot center dot center dot O interactions can be observed in the packing.},
  language  = {en}
}
@article{UhlemannHefeleLudwigetal.1996,
  author    = {Uhlemann, Erhard and Hefele, Heike and Ludwig, Eberhard and Schilde, Uwe},
  title     = {Crystal structure of methoxo-oxo[benzoylaceton-salicyl hydrazonato(2-)]vanadium(V), C18H17N2O5V},
  issn      = {0044-2968},
  year      = {1996},
  language  = {en}
}
@article{ElamparuthiLinkerKellingetal.2009,
  author    = {Elamparuthi, Elangovan and Linker, Torsten and Kelling, Alexandra and Schilde, Uwe},
  title     = {Crystal structure of methyl 3,4-di-O-benzyl-2-deoxy-2-C-nitromethyl-alpha-D-arabinopyranoside, C21H25NO6},
  issn      = {1433-7266},
  doi       = {10.1524/ncrs.2009.0027},
  year      = {2009},
  language  = {en}
}
@article{KovacsTothKleinpeteretal.2003,
  author    = {Kovacs, J. and Toth, G. and Kleinpeter, Erich and Schilde, Uwe},
  title     = {Crystal structure of trans, cis-({\~n})-3{\"i}-4-fluorophenyl)-2-phenylspiro[2H-1-benzothiopyran-34H,2{\"i}-oxiran]-4-one 1- oxide, C22H15FO3S},
  issn      = {1433-7266},
  year      = {2003},
  language  = {en}
}
@article{LinkerBramborgKellingetal.2013,
  author    = {Linker, Torsten and Bramborg, Andrea and Kelling, Alexandra and Schilde, Uwe},
  title     = {Crystal structure of trans-1,4-di-(2-(allyloxyethyl)-cyclohexa-2,5-diene-1,4-dicarboxylic acid, C18H24O6},
  series = {Zeitschrift f{\"u}r Kristallographie : international journal for structural, physical and chemical aspects of crystalline materials ; New crystal structures},
  volume    = {228},
  journal   = {Zeitschrift f{\"u}r Kristallographie : international journal for structural, physical and chemical aspects of crystalline materials ; New crystal structures},
  number    = {2},
  publisher = {De Gruyter Oldenbourg},
  address   = {M{\"u}nchen},
  issn      = {1433-7266},
  doi       = {10.1524/ncrs.2013.0124},
  pages     = {243 -- 244},
  year      = {2013},
  abstract  = {C18H24O6, triclinic, P (1) over bar (no. 2), a = 5.726(1) angstrom, b = 8.845(2) angstrom, c = 9.557(2) angstrom, alpha = 105.27(1)degrees, beta = 102.76(1)degrees, gamma = 103.49(1)degrees, V = 433.0 angstrom(3), Z = 1, R-gt(F) = 0.0412, wR(ref)(F-2) = 0.1075, T = 210 K.},
  language  = {en}
}
@article{ShainyanSuslovaSchilde2008,
  author    = {Shainyan, Bagrat A. and Suslova, Elena N. and Schilde, Uwe},
  title     = {Crystal structures and theoretical calculations of trans -2,4,4-trimethyl-4-silathiane 1-oxide and 4,4-dimethyl- 4-silathiane 1,1-dioxide},
  issn      = {1040-0400},
  year      = {2008},
  abstract  = {The crystal and molecular structures of trans-2,4,4-trimethyl-4-silathiane 1-oxide 1 and 4,4-dimethyl-4- silathiane 1,1-dioxide 2 were determined by single crystal X-ray diffraction. Both compounds have the chair conformation with the 2-Me and the S=O group in compound 1 occupying the equatorial positions. The DFT (B3LYP/6-311G(d,p)) and MP2 (MP2/6-311G(d,p)) theoretical calculations nicely reproduce the X-ray experimental geometry. The obtained results are discussed in connection with the electronic and structural properties of the compounds.},
  language  = {en}
}
@article{SchildeKellingUmbreenetal.2016,
  author    = {Schilde, Uwe and Kelling, Alexandra and Umbreen, Sumaira and Linker, Torsten},
  title     = {Crystal structures of three bicyclic carbohydrate derivatives},
  series = {Acta crystallographica Section E ; Crystallographic communications},
  volume    = {72},
  journal   = {Acta crystallographica Section E ; Crystallographic communications},
  number    = {12},
  publisher = {IUCR},
  address   = {Chester},
  issn      = {2056-9890},
  doi       = {10.1107/S2056989016018727},
  pages     = {1839 -- 1844},
  year      = {2016},
  abstract  = {The title compounds, [(1R,3R,4R,5R,6S)-4,5-bis(acetyloxy)-7-oxo-2-oxabicyclo- [4.2.0]octan-3-yl]methyl acetate, C14H18O8, (I), [(1S,4R,5S,6R)-5-acetyloxy-7- hydroxyimino-2-oxobicyclo[4.2.0]octan-4-yl acetate, C11H15NO6, (II), and [(3aR,5R,6R,7R,7aS)-6,7-bis(acetyloxy)-2-oxooctahydropyrano[3,2-b]pyrrol-5- yl]methyl acetate, C14H19NO8, (III), are stable bicyclic carbohydrate derivatives. They can easily be synthesized in a few steps from commercially available glycals. As a result of the ring strain from the four-membered rings in (I) and (II), the conformations of the carbohydrates deviate strongly from the ideal chair form. Compound (II) occurs in the boat form. In the five-membered lactam (III), on the other hand, the carbohydrate adopts an almost ideal chair conformation. As a result of the distortion of the sugar rings, the configurations of the three bicyclic carbohydrate derivatives could not be determined from their NMR coupling constants. From our three crystal structure determinations, we were able to establish for the first time the absolute configurations of all new stereocenters of the carbohydrate rings.},
  language  = {en}
}
@article{SchildeKellingUmbreenetal.2016,
  author    = {Schilde, Uwe and Kelling, Alexandra and Umbreen, Sumaira and Linker, Torsten},
  title     = {Crystal structures of three bicyclic carbohydrate derivatives},
  series = {Acta crystallographica, Section E, Crystallographic communications},
  volume    = {72},
  journal   = {Acta crystallographica, Section E, Crystallographic communications},
  publisher = {International Union of Crystallography},
  address   = {Chester},
  issn      = {2056-9890},
  doi       = {10.1107/S2056989016018727},
  pages     = {1839 -- +},
  year      = {2016},
  abstract  = {The title compounds, [(1R,3R,4R,5R,6S)-4,5-bis(acetyloxy)-7-oxo-2-oxabicyclo-[4.2.0]octan-3-yl]methyl acetate, C14H18O8, (I), [(1S,4R,5S,6R)-5-acetyloxy-7-hydroxyimino-2-oxobicyclo[4.2.0] octan-4-yl acetate, C11H15NO6, (II), and [(3aR, 5R, 6R, 7R, 7aS)-6,7-bis(acetyloxy)-2-oxooctahydropyrano[3,2-b]pyrrol-5-yl] methyl acetate, C14H19NO8, (III), are stable bicyclic carbohydrate derivatives. They can easily be synthesized in a few steps from commercially available glycals. As a result of the ring strain from the four-membered rings in (I) and (II), the conformations of the carbohydrates deviate strongly from the ideal chair form. Compound (II) occurs in the boat form. In the five-membered lactam (III), on the other hand, the carbohydrate adopts an almost ideal chair conformation. As a result of the distortion of the sugar rings, the configurations of the three bicyclic carbohydrate derivatives could not be determined from their NMR coupling constants. From our three crystal structure determinations, we were able to establish for the first time the absolute configurations of all new stereocenters of the carbohydrate rings.},
  language  = {en}
}
@article{KruegerKellingLinkeretal.2019,
  author    = {Krueger, Tobias and Kelling, Alexandra and Linker, Torsten and Schilde, Uwe},
  title     = {Crystal structures of three cyclohexane‑based γ‑spirolactams},
  series = {BMC Chemistry},
  volume    = {13},
  journal   = {BMC Chemistry},
  number    = {69},
  publisher = {Springer International Publishing},
  address   = {Basel},
  issn      = {2661-801X},
  doi       = {10.1186/s13065-019-0586-7},
  pages     = {9},
  year      = {2019},
  abstract  = {The title compounds, 2-azaspiro[4.5]deca-1-one, C₉H₁₅NO, (1a), cis-8-methyl-2-azaspiro[4.5]deca-1-one, C₁₀H₁₇NO, (1b), and trans-8-methyl-2-azaspiro[4.5]deca-1-one, C₁₀H₁₇NO, (1c), were synthesized from benzoic acids 2 in only 3 steps in high yields. Crystallization from n-hexane afforded single crystals, suitable for X-ray diffraction. Thus, the configurations, conformations, and interesting crystal packing effects have been determined unequivocally. The bicyclic skeleton consists of a lactam ring, attached by a spiro junction to a cyclohexane ring. The lactam ring adopts an envelope conformation and the cyclohexane ring has a chair conformation. The main difference between compound 1b and compound 1c is the position of the carbonyl group on the 2-pyrrolidine ring with respect to the methyl group on the 8-position of the cyclohexane ring, which is cis (1b) or trans (1c). A remarkable feature of all three compounds is the existence of a mirror plane within the molecule. Given that all compounds crystallize in centrosymmetric space groups, the packing always contains interesting enantiomer-like pairs. Finally, the structures are stabilized by intermolecular N-H···O hydrogen bonds.},
  language  = {en}
}
@article{SchmidtElizarovSchildeetal.2015,
  author    = {Schmidt, Bernd and Elizarov, Nelli and Schilde, Uwe and Kelling, Alexandra},
  title     = {Dual Role of Acetanilides: Traceless Removal of a Directing Group through Deacetylation/Diazotation and Palladium-Catalyzed C-C-Coupling Reactions},
  series = {The journal of organic chemistry},
  volume    = {80},
  journal   = {The journal of organic chemistry},
  number    = {9},
  publisher = {American Chemical Society},
  address   = {Washington},
  issn      = {0022-3263},
  doi       = {10.1021/acs.joc.5b00272},
  pages     = {4223 -- 4234},
  year      = {2015},
  abstract  = {The acetamide group enables regioselective oxidative ortho-C-H activation reactions, such as Pd-catalyzed acylation. The synthetic utility of these transformations can be significantly enhanced by using the acetamide as a quasi-leaving group in a subsequent conventional Pd-catalyzed coupling or cross-coupling reaction. The concept is illustrated herein for the synthesis of o-alkenyl- and o-arylphenones, which have potential for the synthesis of arylated aromatic heterocycles.},
  language  = {en}
}
@article{MovahedifarModarresiAlamKleinpeteretal.2017,
  author    = {Movahedifar, Fahimeh and Modarresi-Alam, Ali Reza and Kleinpeter, Erich and Schilde, Uwe},
  title     = {Dynamic H-1-NMR study of unusually high barrier to rotation about the partial C-N double bond in N,N-dimethyl carbamoyl 5-aryloxytetrazoles},
  series = {Journal of molecular structure},
  volume    = {1133},
  journal   = {Journal of molecular structure},
  publisher = {Elsevier},
  address   = {Amsterdam},
  issn      = {0022-2860},
  doi       = {10.1016/j.molstruc.2016.12.010},
  pages     = {244 -- 252},
  year      = {2017},
  abstract  = {The synthesis of new N,N-dimethyl carbamoyl 5-aryloxytetrazoles have been reported. Their dynamic H-1-NMR via rotation about C-N bonds in moiety of urea group [a; CO-NMe2 and b; (2-tetrazolyl)N-CO rotations] in the solvents CDCl3 (223-333 K) and DMSO (298-363 K) is studied. Accordingly, the free energies of activation, obtained 16.5 and 16.9 kcal mol(-1) respectively, attributed to the conformational isomerization about the Me2N-C=O bond (a rotation). Moreover, a and b barrier to rotations in 5-((4-methylphenoxy)-N,N-dimethyl-2H-tetrazole-2-carboxamide (P) also were computed at level of B3LYP using 6-311++G** basis set. The optimized geometry parameters are in good agreement with X-ray structure data. The computation of energy barrier for a and b was determined 16.9 and 2.5 kcal mol(-1), respectively. The former is completely in agreement with the result obtained via dynamic NMR. X-ray structure analysis data demonstrate that just 2-acylated tetrazole was formed in the case of 5-(p-tolyloxy)-N,N-dimethyl-2H-tetrazole-2-carboxamide. X-ray data also revealed a planar trigonal orientation of the Me2N group which is coplanar to carbonyl group with the partial double-bond C-N character. It also demonstrates the synperiplanar position of C=O group with tetrazolyl ring. On average, in solution the plane containing carbonyl bond is almost perpendicular to the plane of the tetrazolyl ring (because of steric effects as confirmed by B3LY12/6-311++G**) while the plane containing Me2N group is coplanar with carbonyl bond which is in contrast with similar urea derivatives and it demonstrates the unusually high rotational energy barrier of these compounds. (C) 2016 Elsevier B.V. All rights reserved.},
  language  = {en}
}
@article{StrauchKossmannKellingetal.2016,
  author    = {Strauch, Peter and Kossmann, Alexander and Kelling, Alexandra and Schilde, Uwe},
  title     = {EPR on bis(1,2-dithiosquarato)cuprate(II) in the bis(1,2-dithiosquarato)nickelate(II) host lattice - structure and spectroscopy},
  series = {Chemical papers},
  volume    = {70},
  journal   = {Chemical papers},
  publisher = {De Gruyter},
  address   = {Berlin},
  issn      = {0366-6352},
  doi       = {10.1515/chempap-2015-0154},
  pages     = {61 -- 68},
  year      = {2016},
  abstract  = {EPR spectroscopy is a well suited analytical tool to monitor the electronic situation around paramagnetic metal centres as copper(II) and therefore the structural influences on the paramagnetic ion. 1,2-Dithiosquaratometalates are available by direct synthesis from metal salts with dipotassium-1,2-dithiosquarate and the appropriate counter cations. Synthesis and characterisation of bis(benzyltributylammonium)1,2-dithiosquaratonickelate(II), (BzlBu(3)N)(2)[Ni(dtsq)(2)], and bis(benzyltributylammonium)1,2-dithiosquaratocuprate(II), (BzlBu(3)N)(2)[Cu(dtsq)(2)], with benzyltributylammonium as the counter ion is reported and the X-ray structures of two complexes, (BzlBu(3)N)(2)[Ni(dtsq)(2)] and (BzlBu(3)N)(2)[Cu(dtsq)(2)], are presented. Both complexes, crystallising in the monoclinic space group P2(1)/c, are isostructural with only small differences in the coordination sphere due to the different metal ions. The diamagnetic nickel complex is therefore well suited as a host lattice for the paramagnetic Cu(II) complex to measure EPR for additional structural information. (c) 2015 Institute of Chemistry, Slovak Academy of Sciences},
  language  = {en}
}
@article{AwadKochMickleretal.2012,
  author    = {Awad, Duha Jawad and Koch, Andreas and Mickler, Wulfhard and Schilde, Uwe and Strauch, Peter},
  title     = {EPR spectroscopy of 4, 4 '-Bis(tert-butyl)-2, 2 '-bipyridine-1, 2-dithiolatocuprates(II) in host lattices with different coordination geometries},
  series = {Zeitschrift f{\"u}r anorganische und allgemeine Chemie},
  volume    = {638},
  journal   = {Zeitschrift f{\"u}r anorganische und allgemeine Chemie},
  number    = {6},
  publisher = {Wiley-VCH},
  address   = {Weinheim},
  issn      = {0044-2313},
  doi       = {10.1002/zaac.201100517},
  pages     = {965 -- 975},
  year      = {2012},
  abstract  = {A series of new heteroleptic MN2S2 transition metal complexes with M = Cu2+ for EPR measurements and as diamagnetic hosts Ni2+, Zn2+, and Pd2+ were synthesized and characterized. The ligands are N2 = 4, 4'-bis(tert-butyl)-2, 2'-bipyridine (tBu2bpy) and S2 =1, 2-dithiooxalate, (dto), 1, 2-dithiosquarate, (dtsq), maleonitrile-1, 2-dithiolate, or 1, 2-dicyanoethene-1, 2-dithiolate, (mnt). The CuII complexes were studied by EPR in solution and as powders, diamagnetically diluted in the isostructural planar [NiII(tBu2bpy)(S2)] or[PdII(tBu2bpy)(S2)] as well as in tetrahedrally coordinated[ZnII(tBu2bpy)(S2)] host structures to put steric stress on the coordination geometry of the central CuN2S2 unit. The spin density contributions for different geometries calculated from experimental parameters are compared with the electronic situation in the frontier orbital, namely in the semi-occupied molecular orbital (SOMO) of the copper complex, derived from quantum chemical calculations on different levels (EHT and DFT). One of the hosts, [NiII(tBu2bpy)(mnt)], is characterized by X-ray structure analysis to prove the coordination geometry. The complex crystallizes in a square-planar coordination mode in the monoclinic space group P21/a with Z = 4 and the unit cell parameters a = 10.4508(10) angstrom, b = 18.266(2) angstrom, c = 12.6566(12) angstrom, beta = 112.095(7)degrees. Oxidation and reductions potentials of one of the host complexes, [Ni(tBu2bpy)(mnt)], were obtained by cyclovoltammetric measurements.},
  language  = {en}
}
@article{WessigPickSchilde2011,
  author    = {Wessig, Pablo and Pick, Charlotte and Schilde, Uwe},
  title     = {First example of an atropselective dehydro-Diels-Alder (ADDA) reaction},
  series = {Tetrahedron letters},
  volume    = {52},
  journal   = {Tetrahedron letters},
  number    = {32},
  publisher = {Elsevier},
  address   = {Oxford},
  issn      = {0040-4039},
  doi       = {10.1016/j.tetlet.2011.06.024},
  pages     = {4221 -- 4223},
  year      = {2011},
  abstract  = {A new concept of a stereoselective synthesis of axially chiral biaryls, formed in the course of the dehydro-Diels-Alder (DDA) reaction, has been disclosed. It is based on asymmetric induction of the newly formed chirality axis by a chirality center, which is present in the two synthesized DDA reactants. Depending on the different length of the linkers joining the alkyne moieties the DDA reaction may be triggered photochemically or thermally, where only the thermal variant was stereoselective.},
  language  = {en}
}
@article{HeydenreichPoleschnerSchilde1996,
  author    = {Heydenreich, Matthias and Poleschner, Helmut and Schilde, Uwe},
  title     = {Fluoroselenenylation of Acetylenes with Xenon Difluoride-Diorganyl Diselenides : synthesis and structure elucidation of functionalized Vicinal (E)-Fluoro(organylseleno)olefins},
  year      = {1996},
  language  = {en}
}
@article{ShainyanMoskalikStarkeetal.2010,
  author    = {Shainyan, Bagrat A. and Moskalik, Mikail Yu and Starke, Ines and Schilde, Uwe},
  title     = {Formation of unexpected products in the attempted aziridination of styrene with trifluoromethanesulfonyl nitrene},
  issn      = {0040-4020},
  doi       = {10.1016/j.tet.2010.08.070},
  year      = {2010},
  abstract  = {The reaction of styrene with trifluoromethanesulfonyl nitrene generated from trifluoromethanesulfonamide in the system (t-BuOCl+NaI) results in the formation of trifluoro-N-[2-phenyl-2-(trifluoromethylsulfonyl) aminoethyl]methanesulfonamide, 1-pheny1-2-iodo-ethanol, and 2,5-diphenyl-1,4-bis(trifluoromethyl sulfonyl)piperazine rather than the expected product of aziridination, 2-phenyl-1-(trifluoromethylsulfonyl) aziridine. The mechanism of the reaction is discussed.},
  language  = {en}
}
@article{MondalBhuniaBaburinetal.2013,
  author    = {Mondal, Suvendu Sekhar and Bhunia, Asamanjoy and Baburin, Igor A. and J{\"a}ger, Christian and Kelling, Alexandra and Schilde, Uwe and Seifert, Gotthard and Janiak, Christoph and Holdt, Hans-J{\"u}rgen},
  title     = {Gate effects in a hexagonal zinc-imidazolate-4-amide-5-imidate framework with flexible methoxy substituents and CO2 selectivity},
  series = {Chemical communications},
  volume    = {49},
  journal   = {Chemical communications},
  number    = {69},
  publisher = {Royal Society of Chemistry},
  address   = {Cambridge},
  issn      = {1359-7345},
  doi       = {10.1039/c3cc42156b},
  pages     = {7599 -- 7601},
  year      = {2013},
  abstract  = {A new imidazolate-4-amide-5-imidate based MOF, IFP-7, is generated, having flexible methoxy groups, which act as molecular gates for guest molecules. This allows highly selective CO2 sorption over N-2 and CH4 gases.},
  language  = {en}
}
@article{MondalBhuniaBaburinetal.2008,
  author    = {Mondal, Suvendu Sekhar and Bhunia, Asamanjoy and Baburin, Igor A. and J{\"a}ger, Christian and Kelling, Alexandra and Schilde, Uwe and Seiert, Gotthard and Janiak, Christoph and Holdt, Hans-J{\"u}rgen},
  title     = {Gate effects in a hexagonal zinc-imidazolate-4-amide-5-imidate framework with flexible methoxy substituents and CO2 selectivity},
  doi       = {10.1039/C3CC42156B},
  year      = {2008},
  abstract  = {A new imidazolate-4-amide-5-imidate based MOF, IFP-7, is generated, having flexible methoxy groups, which act as molecular gates for guest molecules. This allows highly selective CO2 sorption over N2 and CH4 gases.},
  language  = {en}
}