THEORETICAL-STUDY OF THE PYROLYSIS OF ESTERS .1. MNDO, AM1 AND ABINITIO CALCULATIONS OF ELIMINATION AND REARRANGEMENT PROCESSES FOR ETHYL FORMIATE

被引：8

作者：

HAMON, L ^{[1
]}

LEVISALLES, J ^{[1
]}

PASCAL, YL ^{[1
]}

机构：

[1] UNIV PIERRE & MARIE CURIE,CHIM ORGAN LAB,CNRS,UA 408,F-75232 PARIS 05,FRANCE

来源：

TETRAHEDRON | 1989年 / 45卷 / 06期

关键词：

D O I：

10.1016/S0040-4020(01)80036-3

中图分类号：

O62 [有机化学];

学科分类号：

070303 ; 081704 ;

摘要：

引用

页码：1711 / 1722

页数：12

共 48 条

[31] A VARIABLE MECHANISM FOR THE NUCLEOPHILIC VINYLIC SUBSTITUTIONS IN A SERIES OF GEM-DIHALOGENATED ALKENES BY A BIDENTATE SULFUR NUCLEOPHILE - AN EXPERIMENTAL AND AM1 THEORETICAL-STUDY
GIMBERT, Y
MORADPOUR, A
DIVE, G
DEHARENG, D
LAHLIL, K
JOURNAL OF ORGANIC CHEMISTRY, 1993, 58 (17): : 4685 - 4690
[32] THEORETICAL-STUDY BY AM1 OF THE METACYCLOPHANES ANTI-[2]METACYCLO[2](1,3)NAPHTHALENOPHANE-1,11-DIENE, DIHYDROPYRENE AND BENZO[A]PYRENE
RIOSERASGARCIA, MJ
HERNANDOHUELMO, JM
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1992, 94 : 147 - 153
[33] THEORETICAL-STUDY OF ORDERING IN LIQUID-CRYSTALS WITH THE HELP OF INTERMOLECULAR INTERACTION ENERGY CALCULATIONS .1. ANISALDEHYDE AZINE
SANYAL, NK
ROYCHOUDHURY, M
OJHA, RP
SHUKLA, SR
RUHELA, KR
MOLECULAR CRYSTALS AND LIQUID CRYSTALS, 1984, 112 (3-4): : 189 - 196
[34] H2O and H2 Interaction with ZnO Surfaces: A MNDO, AM1, and PM3 Theoretical Study with Large Cluster Models
Martins, J. B. L.
Andres, J.
Longo, E.
Taft, C. A.
International Journal of Quantum Chemistry, 57 (05):
[35] H2O and H-2 interaction with ZnO surfaces: A MNDO, AM1, and PM3 theoretical study with large cluster models
Martins, JBL
Andres, J
Longo, E
Taft, CA
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1996, 57 (05) : 861 - 870
[36] Theoretical study of the gas-phase decomposition of neutral α-amino acid ethyl ethyl picolinate and ethyl esters.: Part 2 -: Elimination of ethyl picolinate and ethyl 1-methylpipecolinate
Notario, R
Quijano, J
León, LA
Sánchez, C
Quijano, JC
Alarcón, G
Chamorro, E
Chuchani, G
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2003, 16 (03) : 166 - 174
[37] THEORETICAL-STUDY OF 1-BENZOYLOXY-4,5-DIMETHYL-1,2,3-TRIAZOLE AND ITS CORRESPONDING N-ACYL ISOMERS USING THE AM1 METHOD
THEOCHARIS, AB
ALEXANDROU, NE
PAPADOPOULOS, MG
WAITE, J
JOURNAL OF CHEMICAL RESEARCH-S, 1991, (04): : 104 - 105
[38] Theoretical study of the gas-phase decomposition of neutral α-amino acid ethyl esters.: Part 1 -: The elimination of N,N-dimethylglycine ethyl ester and ethyl 1-piperidineacetate
Quijano, J
Notario, R
Chamorro, E
León, LA
Sánchez, C
Alarcón, G
Quijano, JC
Chuchani, G
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2002, 15 (07) : 413 - 419
[39] THEORETICAL-STUDY OF CS-CONTAINING MOLECULES .1. ABINITIO HARTREE-FOCK PREDICTIONS FOR C2S2
GOMEZJERIA, JS
MORALES, RGE
REYES, LM
ASTROPHYSICAL JOURNAL, 1986, 302 (01): : 488 - 491
[40] THEORETICAL-STUDY OF THE UV SPECTRUM OF ACETYLENE .1. ABINITIO CALCULATION OF SINGLET ELECTRONIC STATES OF ACETYLENE BY A LARGE-SCALE CI METHOD
PERIC, M
BUENKER, RJ
PEYERIMHOFF, SD
MOLECULAR PHYSICS, 1984, 53 (05) : 1177 - 1193

← 1 2 3 4 5 →