摘要
对XCH= CHX (X= F,Cl,O)顺反异构体进行了CNDO/2 量子化学计算. 结果表明,当X= F,Cl时,顺式异构体比反式的稳定,而当X= O时,则是反式的异构体比顺式的稳定.
In this paper, the CNDO/2 calculation of cis and transisomers in XCH=CHX (X=F,Cl,O) molecules has been made. The result shows that the stability of cisisomeride is better than that of transisomers when X=F, Cl, but is worse when X=O.
出处
《华中师范大学学报（自然科学版）》
CAS
CSCD
北大核心
1999年第4期539-542,共4页
Journal of Central China Normal University：Natural Sciences
基金
湖北省自然科学基金
