Nv. Alekseev et al., STUDY OF THE ELECTRONIC-STRUCTURE OF ORGANOGERMANES WITH EXTENDED COORDINATION SPHERE OF GERMANIUM, Russian chemical bulletin, 47(3), 1998, pp. 367-371
The spatial and electronic structures of some organogermanes with exte
nded coordination spheres of the metal were calculated using AMPAC and
HYPER CHEM 4.0 program packages. Interatomic distances, bond angles,
torsion angles, atomic charges, electron densities, bond orders, param
eters of localized and canonical molecular orbitals, etc, were determi
ned. The nature of the additional intramolecular O --> Ge interaction
in the molecules of these compounds was considered.