| ELECTRONIC CONFIGURATIONS OF TRANSITION METAL SANDWICH COMPLEXES |
| |
| 引用本文： | 李前树,唐敖庆. ELECTRONIC CONFIGURATIONS OF TRANSITION METAL SANDWICH COMPLEXES[J]. 中国科学B辑(英文版), 1989, 0(8) |
| |
| 作者姓名： | 李前树 唐敖庆 |
| |
| 作者单位： | Institute of Theoretical Chemistry，Jilin University，Changchun，Institute of Theoretical Chemistry，Jilin University，Changchun |
| |
| 基金项目： | the National Natural Science Foundation of China. |
| |
| 摘 要： | In this paper the electronic configurations of n+1-decker transition metal sandwich com-plexes have been generally discussed by means of the structural rule of transition metalheterocarborans and the numbers of their valence bonding orbitals have been obtained as fol-lows: VBO = 6n + 3-6n + 5,which are not dependent on the properties of transition metal atoms and coordination rings.Then the results of EHMO quantum chemistry calculations of the model skeletons and cor-responding analyses on electronic configurations of actual molecules for double-, triple- andtetra-decker sandwich complexes have been discussed to verify the above formula.
|
ELECTRONIC CONFIGURATIONS OF TRANSITION METAL SANDWICH COMPLEXES |
| |
| LI QIAN-SHU,TANG AO-QIN Institute of Theoretical Chemistry,Jilin University,Changchun. ELECTRONIC CONFIGURATIONS OF TRANSITION METAL SANDWICH COMPLEXES[J]. Science in China(Chemistry), 1989, 0(8) |
| |
| Authors: | LI QIAN-SHU TANG AO-QIN Institute of Theoretical Chemistry Jilin University Changchun |
| |
| Abstract: | In this paper the electronic configurations of n+1-decker transition metal sandwich com-plexes have been generally discussed by means of the structural rule of transition metalheterocarborans and the numbers of their valence bonding orbitals have been obtained as fol-lows: VBO = 6n + 3-6n + 5,which are not dependent on the properties of transition metal atoms and coordination rings.Then the results of EHMO quantum chemistry calculations of the model skeletons and cor-responding analyses on electronic configurations of actual molecules for double-, triple- andtetra-decker sandwich complexes have been discussed to verify the above formula. |
| |
| Keywords: | structural rule metal sandwich complex EHMO calculation |
| 本文献已被 CNKI 等数据库收录！ |
