Kinetic instability of azafullerenes

被引:5
作者
Aihara, J [1 ]
机构
[1] Shizuoka Univ, Fac Sci, Dept Chem, Oya, Shizuoka 4228529, Japan
来源
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 2000年 / 532卷
关键词
azafullerenes; kinetic stability; bond resonance energy;
D O I
10.1016/S0166-1280(00)00505-4
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Many isomers of azafullerenes are predicted to be kinetically stable with positive or small negative bond resonance energies (BREs). However, none of them have been isolated in macroscopic amounts. This fact is presumably associated with the tendency for nascent azafullerenes to eliminate nitrogen atoms as N-2 or CN. Thus, azafullerenes are among the rare examples whose kinetic instability cannot be predicted by the BRE method. However, if someone succeeds in isolating azafullerenes as solids, he or she may possibly notice that some of the isomers with a min BRE > -0.100\beta\ are fairly inert. (C) 2000 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:95 / 102
页数:8
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