QUANTITATIVE ASPECTS OF CHIRALITY .1. METHOD OF DISSYMMETRY FUNCTION

被引:37
作者
KUZMIN, VE
STELMAKH, IB
BEKKER, MB
POZIGUN, DV
机构
[1] Institute of the Academy of Sciences of the Ukraine, Odessa, 270080
关键词
D O I
10.1002/poc.610050603
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
To study molecular features connected with chirality, a procedure for the quantitative estimation of the chirality level of compounds of different classes is needed. A procedure for estimating the molecular asymmetry level relative to mirror-reflection axes of symmetry, S1, S2, S4 and S6, has been developed. The geometrical mean of these parameters is the disymmetry function (DF). To calculate the DF, the molecule must be fixed in the coordinate system, transferred to the main axes of inertia.
引用
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页码:295 / 298
页数:4
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