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Applications of the molecular orbital graph theory (XI)——The molecular moment's method of evaluating π-bond grade and judging relative reactivity of even AH
引用本文:胡式贤,刘晓平,赵洪刚,曹阳.Applications of the molecular orbital graph theory (XI)——The molecular moment's method of evaluating π-bond grade and judging relative reactivity of even AH[J].中国科学B辑(英文版),2000,43(1).
作者姓名:胡式贤  刘晓平  赵洪刚  曹阳
作者单位:HU Shixian,LIU Xiaoping,ZHAO Honggang(Department of Chemistry, Liaoning Normal University, Dalian 116029, China);CAO Yang(Department of Chemistry,Suzhou University,Suzhou 215006, China)  
摘    要:The tree graph method of evaluating the local molecular moment is proposed. By applying this method and the molecular moment formula of π-electron energy in the molecular orbital graph theory, a topological method of using the molecular moment to judge the relatively reactive point of even AH is achieved.

关 键 词:molecular  moment    π-bond  grade    reactivity    molecular  topology.
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