摘要
根据ABEEM-σπ模型计算的Fukui函数、局域软度、全局硬度和电荷分布等物理量,应用硬软酸碱原理和最大硬度原理,合理地解释了典型不对称烯烃加成反应的机制.
Mechanism of the electrophilic addition to a series of asyrmnetric alkenes has been reasonably demonstrated, in terms of Fukui function, local softness,hardness and charge distribution obtained though the ABEEM-σπ model on the basis of local HSAB principle and maximum hardness principle.
出处
《分子科学学报》
CAS
CSCD
2008年第5期365-367,共3页
Journal of Molecular Science
基金
国家自然科学基金资助项目(20633050
20403007)