Activation of Multiple C-H Bonds Promoted by Gold in AuNbO3+ Clusters

被引:47
|
作者
Wu, Xiao-Nan [1 ]
Li, Xiao-Na [1 ]
Ding, Xun-Lei [1 ]
He, Sheng-Gui [1 ]
机构
[1] Chinese Acad Sci, Beijing Natl Lab Mol Sci, State Key Lab Struct Chem Unstable & Stable Speci, Inst Chem, Beijing 100190, Peoples R China
基金
中国国家自然科学基金; 中国博士后科学基金;
关键词
CH activation; cluster compounds; density functional calculations; gold; radical ions; HYDROGEN-ATOM ABSTRACTION; COUPLED ELECTRON-TRANSFER; METAL-OXIDE CLUSTERS; GAS-PHASE; METHANE ACTIVATION; THEORETICAL CHEMISTRY; AEROBIC OXIDATION; AU CLUSTERS; REACTIVITY; OXYGEN;
D O I
10.1002/anie.201207016
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Single, double, triple: Highly selective double H atom abstraction (HAA) from ethane and triple HAA from n-butane by AuNbO3+ clusters have been characterized by mass spectrometry and DFT calculations. The multiple HAAs are initiated by oxygen-centered radicals and promoted by gold. The gold atoms act as electron acceptors during the triple HAAs and help to store a pair of valence electrons between Au and Nb atoms (see picture). Copyright © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.
引用
收藏
页码:2444 / 2448
页数:5
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