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ABEEM-σπ模型在典型Diels-Alder反应立体选择性上的应用
引用本文:李明楠,杨忠志.ABEEM-σπ模型在典型Diels-Alder反应立体选择性上的应用[J].高等学校化学学报,2005,26(11):2082-2085.
作者姓名:李明楠  杨忠志
作者单位:辽宁师范大学化学化工学院,大连,116029
摘    要:利用ABEEM-σπ模型对Diels-Alder反应进行了理论研究,通过计算原子和π键区域的局域软度值,应用局域软度理论对典型的Diels-Alder反应的较高立体选择性给出了合理解释.

关 键 词:ABEEM-σπ模型  Diels-Alder反应  局域软度
文章编号:0251-0790(2005)11-2082-04
收稿时间:12 9 2004 12:00AM
修稿时间:2004-12-09

Application of ABEEM-σπ Model to Stereoselectivity in Classical Diels-Alder Reactions
LI Ming-Nan,YANG Zhong-Zhi.Application of ABEEM-σπ Model to Stereoselectivity in Classical Diels-Alder Reactions[J].Chemical Research In Chinese Universities,2005,26(11):2082-2085.
Authors:LI Ming-Nan  YANG Zhong-Zhi
Institution:Department of Chemistry,Liaoning Normal University,Dalian 116029,China
Abstract:Diels-Alder reaction has a huge application value due to their high stereoselectivity.The reactive region of this kind of cycloaddition includes not only atoms but also the important π bond zones.In this article,we utilized the ABEEM-σπ model to research this kind of reactions,and through the regional softnesses of both the atoms and π bonds,which were calculated by this model,we interpret properly the stereoselectivity of the typical Diels-Alder reaction.
Keywords:ABEEM-σπmodel  Diels-Alder reaction  Local softness
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