TY  - JOUR
A1  - Awad, Duha Jawad
A1  - Conrad, Franziska
A1  - Koch, Andreas
A1  - Friedrich, Alwin
A1  - Poeppl, Andreas
A1  - Strauch, Peter
T1  - 2,2'-Bipyridin-1,2-dithiolat Gemischtligand-Komplexe : Systhese, Charakterisierung und EPR-Spektroskopie
N2  - A series of new 2 2'-bipyridine/1 2-dithiolate transition metal complexes has been synthesised and characterised As 1,2-dithiolate ligands 1,2 dithiooxalate (dto) and 1 2-dithiosquarate (dtsq) were used It follows from the IR spectra that the multidentate dithiolate ligands coordinate exclusively via their sulfur atoms forming an MN2S2 coordination sphere The central metal ions (M) are Cu2+ Ni2+ Pd2+ Pt2+, and Zn2+ The complex [Cu-II(bpy)(dto)] could be studied by EPR spectroscopy and was measured as powder diamagnetically diluted in the isostructural [Ni-II(bpy)(dto)] host structure The spin density contribution calculated from the experimental parameters is compared with the electronic situation in the frontier orbitals namely in the semi occupied SOMO of the copper complex derived from quantum chemical calculations on different levels (EHT and DFT)
Y1  - 2010
UR  - http://www.znaturforsch.com/b.htm
SN  - 0932-0776
ER  - 
TY  - THES
A1  - Koch, Andreas
T1  - Quantenchemische Untersuchungen von Tautomeriegleichgewichten und von Rotationsbarrieren um partielle C,N- Doppelbindungen
Y1  - 2001
ER  -