On some carbon clusters containing sp(2)- and sp(3)-hybridized atoms

被引：1

作者：

Halpern, EG ^{[1
]}

Pinyaskin, VV ^{[1
]}

Stankevich, IV ^{[1
]}

机构：

[1] AN NESMEYANOV ORGANOELEMENT CPDS INST,MOSCOW 117813,RUSSIA

来源：

RUSSIAN CHEMICAL BULLETIN | 1996年 / 45卷 / 03期

关键词：

fullerenes; carbon clusters; quantum-chemical methods; MNDO; MNDO-PM3;

D O I：

10.1007/BF01435772

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

A new class of thread-like carbon clusters consisting of dodecahedra and containing sp(2)- and sp(3)-hybridized atoms is described. Molecular and electronic structures of the simplest representative of this class (the C-102 cluster) and of the polyhedral C90H12 hydrocarbon molecule, whose carbon framework is identical to the toroidal fragment of the C-102 cluster, have been calculated by the MNDO and MNDO-PM3 methods.

引用

页码：511 / 513

页数：3

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