ABINITIO SCF-MO RESULTS FOR THE CARBORANE ISOMERS 3,5-C2B6H8, 1,7-C2B7H9, AND 1,2-C2B7H9

被引：8

作者：

GIMARC, BM ^{[1
]}

DAI, BC ^{[1
]}

OTT, JJ ^{[1
]}

机构：

[1] FURMAN UNIV,DEPT CHEM,GREENVILLE,SC 29613

来源：

JOURNAL OF COMPUTATIONAL CHEMISTRY | 1989年 / 10卷 / 01期

关键词：

D O I：

10.1002/jcc.540100103

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：14 / 16

页数：3

共 14 条

[1]

BINKLEY JS, 1984, GAUSSIAN 82

[2] ISOMERS OF C2B3H5 AND THE DIAMOND SQUARE DIAMOND REARRANGEMENT MECHANISM [J].

GIMARC, BM ;

OTT, JJ .

INORGANIC CHEMISTRY, 1986, 25 (01) :83-85

[3] POSSIBLE MECHANISMS FOR THE ISOMERIZATION OF B9H92- AND C2B7H9 [J].

GIMARC, BM ;

OTT, JJ .

INORGANIC CHEMISTRY, 1986, 25 (16) :2708-2711

[4] ISOMERIZATION OF CARBORANES C2B6H8, C2B8H10, AND C2B9H11 BY THE DIAMOND SQUARE DIAMOND REARRANGEMENT [J].

GIMARC, BM ;

OTT, JJ .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1987, 109 (05) :1388-1392

[5] POLYHEDRAL REARRANGEMENTS IN CLUSTER COMPOUNDS [J].

JOHNSON, BFG .

JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS, 1986, (01) :27-30

[6] CHEMICAL APPLICATIONS OF TOPOLOGY AND GROUP-THEORY .20. 8-VERTEX POLYHEDRA AND THEIR REARRANGEMENTS [J].

KING, RB .

INORGANIC CHEMISTRY, 1986, 25 (04) :506-510

[7] ABINITIO STUDY OF THE MECHANISMS OF REARRANGEMENTS IN C2B4H6 AND C2B5H7 [J].

MCKEE, ML .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1988, 110 (16) :5317-5321

[8]

MCKEE ML, IN PRESS INORG CHEM

[9]

MINGOS DMP, IN PRESS POLYHEDRON

[10] PREDICTIONS OF RELATIVE STABILITIES AMONG SERIES OF CARBORANE ISOMERS BY THE CRITERION OF TOPOLOGICAL CHARGE STABILIZATION [J].

OTT, JJ ;

GIMARC, BM .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1986, 108 (15) :4303-4308

← 1 2 →