THEORETICAL DETERMINATION OF MOLECULAR-STRUCTURE AND CONFORMATION .4. ELECTRONIC EFFECTS INFLUENCING THE STABILITY OF METHYL-SUBSTITUTED PRIMARY OZONIDES

被引:52
作者
CREMER, D
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D O I
10.1063/1.437670
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
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页码:1911 / 1927
页数:17
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[1]   MICROWAVE SPECTRUM OF NORMAL PROPYL ALCOHOL [J].
ABDURAHM.AA ;
RAHIMOVA, RA ;
IMANOV, LM .
PHYSICS LETTERS A, 1970, A 32 (02) :123-&
[2]   MECHANISM OF OZONOLYSIS - MORE FLEXIBLE STEREOCHEMICAL CONCEPT [J].
BAILEY, PS ;
FERRELL, TM .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1978, 100 (03) :899-905
[3]   STRUCTURE OF INITIAL OZONE-OLEFIN ADDUCT [J].
BAILEY, PS ;
THOMPSON, JA ;
SHOULDER.BA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1966, 88 (17) :4098-&
[4]   STEREOSPECIFICITY IN OZONIDE AND CROSS-OZONIDE FORMATION [J].
BAULD, NL ;
THOMPSON, JA ;
HUDSON, CE ;
BAILEY, PS .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1968, 90 (07) :1822-&
[5]   GROUND-STATES OF MOLECULES .25. MINDO-3 - IMPROVED VERSION OF MINDO SEMIEMPIRICAL SCF-MO METHOD [J].
BINGHAM, RC ;
DEWAR, MJS ;
LO, DH .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1285-1293
[6]   APPROXIMATE RELATIONS BETWEEN ORBITAL SCF ENERGIES AND TOTAL SCF ENERGIES IN MOLECULES [J].
BOYD, DB .
JOURNAL OF CHEMICAL PHYSICS, 1977, 67 (04) :1787-1788
[7]   GENERAL DEFINITION OF RING PUCKERING COORDINATES [J].
CREMER, D ;
POPLE, JA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1354-1358
[9]   THEORETICAL DETERMINATION OF MOLECULAR-STRUCTURE AND CONFORMATION .1. ROLE OF BASIS SET AND CORRELATION EFFECTS IN CALCULATIONS ON HYDROGEN-PEROXIDE [J].
CREMER, D .
JOURNAL OF CHEMICAL PHYSICS, 1978, 69 (10) :4440-4445
[10]   MOLECULAR-ORBITAL THEORY OF ELECTRONIC-STRUCTURE OF ORGANIC COMPOUNDS .23. PSEUDOROTATION IN SATURATED 5-MEMBERED RING COMPOUNDS [J].
CREMER, D ;
POPLE, JA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1358-1367