TI8C-12 - A POLYTOPAL MOLECULE WITH 36 TI-C BONDS

被引：67

作者：

ROHMER, MM

BENARD, M

HENRIET, C

BO, C

POBLET, JM

机构：

[1] UNIV STRASBOURG 1,CHIM QUANT LAB,CNRS,UPR 139,4 RUE B PASCAL,F-67070 STRASBOURG,FRANCE

[2] CRAY RES FRANCE,F-75017 PARIS,FRANCE

[3] UNIV ROVIRA VIRGILI,DEPT QUIM,E-43005 TARRAGONA,SPAIN

来源：

JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS | 1993年 / 15期

关键词：

D O I：

10.1039/c39930001182

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

The Ti8C12 molecule, recently observed as a positive ion by Castleman et al., is presented as a cluster with seven possible conformations which have been characterized as local minima by means of ab initio Hartree-Fock calculations.

引用

页码：1182 / 1185

页数：4

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