THE BARRIER TO INTERNAL-ROTATION IN ETHANE

被引：110

作者：

PITZER, RM

机构：

来源：

ACCOUNTS OF CHEMICAL RESEARCH | 1983年 / 16卷 / 06期

关键词：

D O I：

10.1021/ar00090a004

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：207 / 210

页数：4

共 65 条

[51]

PITZER RM, 1964, QCPE, V10, P22

[52] NEW DEVELOPMENTS IN MOLECULAR ORBITAL THEORY [J].

ROOTHAAN, CCJ .

REVIEWS OF MODERN PHYSICS, 1951, 23 (02) :69-89

[53]

SCHAEFER HF, 1972, ELECTRONIC STRUCTURE

[54] MULTICENTER INTEGRALS IN MOLECULAR QUANTUM MECHANICS [J].

SHAVITT, I ;

KARPLUS, M .

JOURNAL OF CHEMICAL PHYSICS, 1962, 36 (02) :550-&

[55]

SHAVITT I, 1963, METHODS COMPUTATIONA, V2, P1

[56] THE INFRA-RED SPECTRUM OF C2H6 [J].

SMITH, LG .

JOURNAL OF CHEMICAL PHYSICS, 1949, 17 (02) :139-167

[57] DISTORTIONAL EFFECTS ON ETHANE INTERNAL-ROTATION BARRIER [J].

SOVERS, OJ ;

KARPLUS, M .

JOURNAL OF CHEMICAL PHYSICS, 1966, 44 (08) :3033-&

[58] BOND-FUNCTION ANALYSIS OF ROTATIONAL BARRIERS - ETHANE [J].

SOVERS, OJ ;

KERN, CW ;

PITZER, RM ;

KARPLUS, M .

JOURNAL OF CHEMICAL PHYSICS, 1968, 49 (06) :2592-&

[59] TEST OF CLOSED-SHELL OVERLAP-REPULSION MODEL FOR ETHANE BARRIER [J].

STEVENS, RM ;

KARPLUS, M .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1972, 94 (14) :5140-&

[60]

VEILLARD A, 1974, INTERNAL ROTATION MO

← 1 2 3 4 5 6 7 →