APPRAISAL OF SOLVATION EFFECTS ON CHEMICAL FUNCTIONAL-GROUPS - AMIDES AND ESTERS IN TERMS OF TRANSFERABLE SUBGROUP CONTRIBUTIONS

被引：29

作者：

ALAGONA, G

GHIO, C

IGUAL, J

TOMASI, J

机构：

[1] UNIV PISA,DIPARTIMENTO CHIM & CHIM IND,I-56126 PISA,ITALY

[2] FAC CIENCIAS TARRAGONA,DEPT QUIM FIS,TARRAGONA,SPAIN

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1989年 / 111卷 / 09期

关键词：

D O I：

10.1021/ja00191a045

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

收藏

页码：3417 / 3421

页数：5

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共 14 条

[1] A GENERAL CALCULATION OF MOLECULAR SOLVATION ENERGIES
ABRAHAM, RJ
HUDSON, BD
KERMODE, MW
MINES, JR
[J]. JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS I, 1988, 84 : 1911 - 1917
[2] TOWARDS A UNIFIED VIEW OF THE DESCRIPTION OF INTERNAL AND EXTERNAL FIELDS ACTING ON CHEMICAL FUNCTIONAL-GROUPS
ALAGONA, G
BONACCORSI, R
GHIO, C
MONTAGNANI, R
TOMASI, J
[J]. PURE AND APPLIED CHEMISTRY, 1988, 60 (02) : 231 - 244
[3] ALAGONA G, 1986, J MOL STRUC-THEOCHEM, V135, P39
[4] ALAGONA G, IN PRESS J MOL STRUC
[5] BONACCORSI R, 1980, ISRAEL J CHEM, V19, P109
[6] ON A SEMICLASSICAL INTERPRETATION OF INTERMOLECULAR AND INTRAMOLECULAR INTERACTIONS
BONACCORSI, R
GHIO, C
TOMASI, J
[J]. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1984, 26 (05) : 637 - 686
[7] ATOMIC CHARGES DERIVED FROM ELECTROSTATIC POTENTIALS - A DETAILED STUDY
CHIRLIAN, LE
FRANCL, MM
[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1987, 8 (06) : 894 - 905
[8] A SUPERTENSOR FORMALISM FOR SOLUTE CONTINUUM SOLVENT INTERACTIONS WITH AN ARBITRARILY SHAPED CAVITY .1. THEORY AND IMPLEMENTATION
DRUMMOND, MLJ
[J]. JOURNAL OF CHEMICAL PHYSICS, 1988, 88 (08) : 5014 - 5020
[9] A SUPERTENSOR FORMALISM FOR SOLUTE CONTINUUM SOLVENT INTERACTIONS WITH AN ARBITRARILY SHAPED CAVITY .2. PRELIMINARY APPLICATIONS TO MODEL SYSTEMS
DRUMMOND, MLJ
[J]. JOURNAL OF CHEMICAL PHYSICS, 1988, 88 (08) : 5021 - 5026
[10] CANONICAL CONFIGURATIONAL INTERACTION PROCEDURE
FOSTER, JM
BOYS, SF
[J]. REVIEWS OF MODERN PHYSICS, 1960, 32 (02) : 300 - 302