THEORETICAL CHARACTERIZATION OF C70CL10 - THE ROLE OF 1,4-ADDITION ACROSS HEXAGONAL RINGS

被引:33
作者
AUSTIN, SJ [1 ]
FOWLER, PW [1 ]
SANDALL, JPB [1 ]
BIRKETT, PR [1 ]
AVENT, AG [1 ]
DARWISH, AD [1 ]
KROTO, HW [1 ]
TAYLOR, R [1 ]
WALTON, DRM [1 ]
机构
[1] UNIV SUSSEX,SCH CHEM & MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
来源
JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2 | 1995年 / 06期
关键词
D O I
10.1039/p29950001027
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
Four isomeric structures of decachloro [70]fullerene are compatible with the C-13 NMR spectrum and qualitative stability rules; explicit calculation at the semi-empirical level shows the most stable isomer to be that which maximises the number of 1,4-chlorine additions whilst excluding double bonds from pentagons.
引用
收藏
页码:1027 / 1028
页数:2
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