STABILITIES AND STRUCTURES OF C6F6-(C6F6) AND C6F6+(C6F6)

被引:34
作者
HIRAOKA, K [1 ]
MIZUSE, S [1 ]
YAMABE, S [1 ]
机构
[1] NARA UNIV EDUCAT,DEPT CHEM,TAKABATAKE,NARA 630,JAPAN
关键词
D O I
10.1021/j100372a061
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
The equilibria of clustering reactions C6F6∓ + C6F6 = C6F6∓(C6F6) were studied with a pulsed electron beam high-pressure mass spectrometer. Thermochemical stabilities of the clusters C6F6-(C6F6) and C6F6+(C6F6) were determined. It was found that the bond energy of C6F6-(C6F6) is larger than that of C6F6+(C6F6). While C6F6+(C6F6) has the site-to-site type geometry, C6F6-(C6F6) has a stack form according to the ab initio MO calculation. © 1990 American Chemical Society.
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页码:3689 / 3694
页数:6
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