Chemical reactivity and selectivity: Local HSAB principle versus frontier orbital theory

被引：207

作者：

Chattaraj, PK ^{[1
]}

机构：

[1] Indian Inst Technol, Dept Chem, Kharagpur 721302, W Bengal, India

来源：

JOURNAL OF PHYSICAL CHEMISTRY A | 2001年 / 105卷 / 02期

关键词：

D O I：

10.1021/jp003786w

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

It has been argued that the maximum Fukui function site is the best for the frontier-controlled soft-soft reactions whereas for the charge-controlled hard-hard interactions the preferred site is associated with the maximum net charge and not necessarily the minimum Fukui function.

引用

页码：511 / 513

页数：3

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