ANALYSIS OF SOLVENT EFFECT ON SN2 REACTIONS BY DIFFERENT THEORETICAL-MODELS

[1] FREE-ENERGY PERTURBATION METHOD FOR CHEMICAL-REACTIONS IN THE CONDENSED PHASE - A DYNAMICAL-APPROACH BASED ON A COMBINED QUANTUM AND MOLECULAR MECHANICS POTENTIAL [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1987, 109 (26) : 8092 - 8094

[2] MOLECULAR-DYNAMICS OF A MODEL SN2 REACTION IN WATER [J]. JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (03) : 1356 - 1376

[3] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .21. SMALL SPLIT-VALENCE BASIS-SETS FOR 1ST-ROW ELEMENTS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1980, 102 (03) : 939 - 947

[4] ACTIVATION-ENERGIES IN NUCLEOPHILIC DISPLACEMENT-REACTIONS MEASURED AT 296 DEGREES K IN-VACUO [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (12) : 4027 - 4028

[5] KINETIC STUDIES OF REACTIONS OF OXIDE, HYDROXIDE, ALKOXIDE, PHENYL, AND BENZYLIC ANIONS WITH METHYL CHLORIDE IN GAS PHASE AT 22,5 DEGREES [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1970, 92 (25) : 7354 - &

[6] BRIDGING THE GAP BETWEEN THE GAS-PHASE AND SOLUTION - TRANSITION IN THE KINETICS OF NUCLEOPHILIC DISPLACEMENT-REACTIONS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1981, 103 (04) : 978 - 979

[7] ABINITIO EVALUATION OF ABSORPTION AND EMISSION TRANSITIONS FOR MOLECULAR SOLUTES, INCLUDING SEPARATE CONSIDERATION OF ORIENTATIONAL AND INDUCTIVE SOLVENT EFFECTS [J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1983, 4 (04) : 567 - 577

[8] CONFORMATIONAL ENERGY OF GLYCINE IN AQUEOUS-SOLUTIONS AND RELATIVE STABILITY OF THE ZWITTERIONIC AND NEUTRAL FORMS - AN ABINITIO STUDY [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1984, 106 (07) : 1945 - 1950

[9] GAS-PHASE NUCLEOPHILIC DISPLACEMENT-REACTIONS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (12) : 4030 - 4031

[10] BURSHTEIN KY, 1987, J MOL STRUCT THEOCHE, V153, P209

[1] FREE-ENERGY PERTURBATION METHOD FOR CHEMICAL-REACTIONS IN THE CONDENSED PHASE - A DYNAMICAL-APPROACH BASED ON A COMBINED QUANTUM AND MOLECULAR MECHANICS POTENTIAL [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1987, 109 (26) : 8092 - 8094

[2] MOLECULAR-DYNAMICS OF A MODEL SN2 REACTION IN WATER [J]. JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (03) : 1356 - 1376

[3] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .21. SMALL SPLIT-VALENCE BASIS-SETS FOR 1ST-ROW ELEMENTS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1980, 102 (03) : 939 - 947

[4] ACTIVATION-ENERGIES IN NUCLEOPHILIC DISPLACEMENT-REACTIONS MEASURED AT 296 DEGREES K IN-VACUO [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (12) : 4027 - 4028

[5] KINETIC STUDIES OF REACTIONS OF OXIDE, HYDROXIDE, ALKOXIDE, PHENYL, AND BENZYLIC ANIONS WITH METHYL CHLORIDE IN GAS PHASE AT 22,5 DEGREES [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1970, 92 (25) : 7354 - &

[6] BRIDGING THE GAP BETWEEN THE GAS-PHASE AND SOLUTION - TRANSITION IN THE KINETICS OF NUCLEOPHILIC DISPLACEMENT-REACTIONS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1981, 103 (04) : 978 - 979

[7] ABINITIO EVALUATION OF ABSORPTION AND EMISSION TRANSITIONS FOR MOLECULAR SOLUTES, INCLUDING SEPARATE CONSIDERATION OF ORIENTATIONAL AND INDUCTIVE SOLVENT EFFECTS [J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1983, 4 (04) : 567 - 577

[8] CONFORMATIONAL ENERGY OF GLYCINE IN AQUEOUS-SOLUTIONS AND RELATIVE STABILITY OF THE ZWITTERIONIC AND NEUTRAL FORMS - AN ABINITIO STUDY [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1984, 106 (07) : 1945 - 1950

[9] GAS-PHASE NUCLEOPHILIC DISPLACEMENT-REACTIONS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (12) : 4030 - 4031

[10] BURSHTEIN KY, 1987, J MOL STRUCT THEOCHE, V153, P209