MONTE-CARLO CALCULATIONS OF SOLVENT EFFECT IN THE REACTION F- + CH3F = F...CH3...F-

被引:5
作者
CERNUSAK, I
URBAN, M
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D O I
10.1135/cccc19841854
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O6 [化学];
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0703 ;
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页码:1854 / 1868
页数:15
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[1]  
ABRONIN IA, 1980, ZH STRUKT KHIM, V21, P145
[2]   POSSIBLE CATALYTIC EFFECT OF WATER ON SOME NUCLEOPHILIC-SUBSTITUTION REACTIONS IN INERT SOLVENTS [J].
ALAGONA, G ;
SCROCCO, E ;
TOMASI, J .
THEORETICA CHIMICA ACTA, 1978, 47 (02) :133-145
[3]  
Ben-Naim A., 1974, WATER AQUEOUS SOLUTI
[4]   AB INITIO CALCULATIONS ON A TYPICAL SN2REACTION - ELECTRONIC STRUCTURE OF METHYL FLUORIDE AND OF TRANSITION STATE (FCH3F)- [J].
BERTHIER, G ;
DAVID, DJ ;
VEILLARD, A .
THEORETICA CHIMICA ACTA, 1969, 14 (04) :329-&
[5]  
BERTRAN J, 1981, STUDIES PHYS THEOR C, V21, P379
[6]   METHANE IN AQUEOUS-SOLUTION AT 300-DEGREES-K [J].
BOLIS, G ;
CLEMENTI, E .
CHEMICAL PHYSICS LETTERS, 1981, 82 (01) :147-152
[7]  
CARSKY P, 1980, LECT NOTES CHEM, V16
[8]  
CERNUSAK I, 1982, CHEM ZVESTI, V36, P749
[9]  
CERNUSAK I, 1978, COLLECT CZECH CHEM C, V43, P1956
[10]  
CERNUSAK I, UNPUB