RE-EXAMINATION OF ORIGIN OF REGIOSELECTIVITY IN DIMERIZATION OF ACROLEIN - FRONTIER ORBITAL APPROACH

被引:48
作者
ALSTON, PV
SHILLADY, DD
机构
[1] DUPONT CO,ANAL RES GRP,SPRUANCE PLANT,RICHMOND,VA 23261
[2] VIRGINIA COMM UNIV,DEPT CHEM,RICHMOND,VA 23284
关键词
D O I
10.1021/jo00937a021
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
引用
收藏
页码:3402 / 3406
页数:5
相关论文
共 20 条
[1]   SECONDARY ORBITAL INTERACTIONS DETERMINING REGIOSELECTIVITY IN DIELS-ALDER REACTION [J].
ALSTON, PV ;
OTTENBRI.RM ;
SHILLADY, DD .
JOURNAL OF ORGANIC CHEMISTRY, 1973, 38 (23) :4075-4077
[2]   ATOMIC SCREENING CONSTANTS FROM SCF FUNCTIONS [J].
CLEMENTI, E ;
RAIMONDI, DL .
JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (11) :2686-&
[3]   INTERMOLECULAR ORBITAL THEORY .3. THERMAL AND PHOTOCHEMICAL DIMERIZATION OF UNSATURATED KETONES [J].
DEVAQUET, A ;
SALEM, L .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1969, 91 (14) :3793-&
[5]   ITERATIVE EXTENDED HUCKEL METHOD (IEHM) [J].
DUKE, BJ .
THEORETICA CHIMICA ACTA, 1968, 9 (03) :260-&
[6]  
EISENSTEIN O, 1971, CHEM COMMUN, P969
[7]   METHOD OF RAPIDLY OPTIMIZING BOND LENGTHS IN ALL-VALENCE ELECTRON SCF-MO CALCULATIONS [J].
HASHMALL, JA ;
RAYNOR, S .
JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (12) :5464-5468
[9]   THEORY OF CYCLOADDITION REACTIONS [J].
HERNDON, WC .
CHEMICAL REVIEWS, 1972, 72 (02) :157-&
[10]   GENERALIZED FRONTIER ORBITALS OF ALKENES AND DIENES - REGIOSELECTIVITY IN DIELS-ALDER REACTIONS [J].
HOUK, KN .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (12) :4092-4094