ABINITIO AND EMPIRICAL COMPUTATIONS OF MECHANISM AND STEREOSELECTIVITY

被引：30

作者：

HOUK, KN

机构：

来源：

PURE AND APPLIED CHEMISTRY | 1989年 / 61卷 / 04期

关键词：

D O I：

10.1351/pac198961040643

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：643 / 650

页数：8

共 26 条

[1]

[Anonymous], UNPUB

[2]

Bartlett, 1971, PURE APPL CHEM, V27, P597

[3] MC-SCF STUDY OF THE DIELS-ALDER REACTION BETWEEN ETHYLENE AND BUTADIENE [J].

BERNARDI, F ;

BOTTONI, A ;

FIELD, MJ ;

GUEST, MF ;

HILLIER, IH ;

ROBB, MA ;

VENTURINI, A .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1988, 110 (10) :3050-3055

[4] THEORETICAL-STUDY OF (2 + 2) CYCLO-ADDITIONS - KETENE WITH ETHYLENE [J].

BURKE, LA .

JOURNAL OF ORGANIC CHEMISTRY, 1985, 50 (17) :3149-3155

[5]

BURKERT U, 1982, ACS MONOGRAPH AM CHE, V177

[6] THEORETICAL-EXAMINATION OF THE SN2 REACTION INVOLVING CHLORIDE-ION AND METHYL-CHLORIDE IN THE GAS-PHASE AND AQUEOUS-SOLUTION [J].

CHANDRASEKHAR, J ;

SMITH, SF ;

JORGENSEN, WL .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1985, 107 (01) :154-163

[7] MECHANISM OF THE DIELS-ALDER REACTION - REACTIONS OF BUTADIENE WITH ETHYLENE AND CYANOETHYLENES [J].

DEWAR, MJS ;

OLIVELLA, S ;

STEWART, JJP .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1986, 108 (19) :5771-5779

[8] THE DEVELOPMENT AND USE OF QUANTUM-MECHANICAL MOLECULAR-MODELS .76. AM1 - A NEW GENERAL-PURPOSE QUANTUM-MECHANICAL MOLECULAR-MODEL [J].

DEWAR, MJS ;

ZOEBISCH, EG ;

HEALY, EF ;

STEWART, JJP .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1985, 107 (13) :3902-3909

[9] FORBIDDEN REACTIONS - [2 + 2] CYCLOREVERSION OF RIGID CYCLOBUTANES [J].

DOERING, WV ;

ROTH, WR ;

BREUCKMANN, R ;

FIGGE, L ;

LENNARTZ, HW ;

FESSNER, WD ;

PRINZBACH, H .

CHEMISCHE BERICHTE-RECUEIL, 1988, 121 (01) :1-9

[10]

FRISCH MJ, 1984, GAUSSIAN 86

← 1 2 3 →