STRAIN-ENERGY MINIMIZATION STUDY OF THE MECHANISM OF, AND THE BARRIER TO, CONFORMATIONAL INTERCONVERSION IN 5-MEMBERED DIAMINE CHELATE RINGS

被引:31
作者
HAMBLEY, TW
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D O I
10.1002/jcc.540080510
中图分类号
O6 [化学];
学科分类号
0703 ;
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页码:651 / 657
页数:7
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共 25 条
[21]   USE OF CONSTRAINTS IN EVALUATION OF MOLECULAR STRAIN ENERGIES SPECIFIED BY EMPIRICAL VALENCE-FORCE POTENTIALS [J].
THOMAS, MW ;
EMERSON, D .
JOURNAL OF MOLECULAR STRUCTURE, 1973, 16 (03) :473-482
[22]   THE LAGRANGE MULTIPLIER METHOD FOR MANIPULATING GEOMETRIES - IMPLEMENTATION AND APPLICATIONS IN MOLECULAR MECHANICS [J].
VANDEGRAAF, B ;
BAAS, JMA .
JOURNAL OF COMPUTATIONAL CHEMISTRY, 1984, 5 (04) :314-321
[23]  
VANDEGRAAF B, 1980, RECL TRAV CHIM PAY B, V99, P175
[24]  
VANDEGRAAF B, 1980, RECL TRAV CHIM PAY B, V99, P327
[25]   APPLICATION OF STRAIN ENERGY MINIMIZATION TO DYNAMICS OF CONFORMATIONAL-CHANGES [J].
WIBERG, KB ;
BOYD, RH .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1972, 94 (24) :8426-&