THEORETICAL ASPECTS OF PHOTOCHEMICAL SUBSTITUTION OF (MN(CO)5CL) AND RELATED COMPLEXES

被引:9
作者
PIERLOOT, K [1 ]
HOET, P [1 ]
VANQUICKENBORNE, LG [1 ]
机构
[1] UNIV LOUVAIN,DEPT CHEM,CELESTIJNENLAAN 200F,B-3001 HEVERLEE,BELGIUM
来源
JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS | 1991年 / 09期
关键词
D O I
10.1039/dt9910002363
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
A self-consistent field analysis of the photolysis of [Mn(CO)5Cl] has been performed. Based on electron-density difference plots and population analysis a correlation is made between the nature of the photoactive state and the preferential leaving ligand. The stereochemistry of the photolysis reaction has been determined by a study of the possible excited-state isomerization pathways of the five-co-ordinated structure [Mn(CO)4Cl]. The analysis confirms the experimentally observed trans --> cis stereopreference.
引用
收藏
页码:2363 / 2369
页数:7
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