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M⁺(M = 硅、锗、锡和铅)与苯在气相中的反应。

Reactions between M+ (M = Si, Ge, Sn and Pb) and benzene in the gas phase.

作者信息

Xing Xiaopeng, Tian Zhixin, Liu Hongtao, Tang Zichao

机构信息

State Key Laboratory of Molecular Reaction Dynamics, Center of Molecular Science, Institute of Chemistry, Chinese Academy of Sciences, Beijing 100080, People's Republic of China.

出版信息

Rapid Commun Mass Spectrom. 2003;17(15):1743-8. doi: 10.1002/rcm.1115.

DOI:10.1002/rcm.1115
PMID:12872279
Abstract

Using a laser ablation/inert buffer gas ion source coupled with a reflectron time-of-flight mass spectrometer, the gas-phase reactions between the IVA group element ions M(+) (M = Si, Ge, Sn and Pb) and benzene seeded in argon gas were studied. In addition to the association reaction pathway (forming M(C(6)H(6))(x), x = 1, 2, etc.), benzene was dissociated to form complex ions M(C(5)H(5)), M(C(7)H(5)) and M(C(9)H(x)) (x = 5, 7 and 9), etc. DFT theoretical calculations indicated that, in the association products M(C(6)H(6)), the M atom is close to one carbon atom of benzene, while in most of the dissociation complexes, pentagonal structures (M/cyclopentadienyl derivatives) were formed, with the M atom situated near the fivefold axis of the five-membered ring. The bond patterns in these complexes are discussed.

摘要

使用激光烧蚀/惰性缓冲气体离子源与反射式飞行时间质谱仪相结合,研究了IVA族元素离子M(+)(M = Si、Ge、Sn和Pb)与氩气中掺杂的苯之间的气相反应。除了缔合反应途径(形成M(C₆H₆)ₓ,x = 1、2等)外,苯还会解离形成络合离子M(C₅H₅)、M(C₇H₅)和M(C₉Hₓ)(x = 5、7和9等)。密度泛函理论计算表明,在缔合产物M(C₆H₆)中,M原子靠近苯的一个碳原子,而在大多数解离络合物中,形成了五角结构(M/环戊二烯基衍生物),M原子位于五元环的五重轴附近。讨论了这些络合物中的键型。

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