| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 10570541 | Inorganic Chemistry Communications | 2005 | 4 Pages |
Abstract
The geometrical structure and bonding in adducts [Mo6S8(CN)12 · Cr(CO)4L]6â (L = CO, PH3, PF3, P(OCH3)3) were studied on the base of quantum chemical calculations. The main attention was paid to the study of the changes in the cluster geometry under the influence of the attached Cr(CO)4L group. The large deformations in the Mo6 core were found and explained by the electrostatic interaction and the pseudo-Jhan-Teller effect.
Related Topics
Physical Sciences and Engineering
Chemistry
Inorganic Chemistry
![Quantum chemical study of the addition effect on the geometry of the [Mo6S8(CN)6]6â cluster](/preview/png/10570541.png "First Page Preview: Quantum chemical study of the addition effect on the geometry of the [Mo6S8(CN)6]6â cluster")
Authors
V.I. Baranovski, S.P. Tunik, D.V. Korolkov,