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Mechanism, Reactivity, and Selectivity in Rh(III)-Catalyzed Phosphoryl-Directed Oxidative C-H Activation/Cyclization: A DFT Study 期刊论文
http://dx.doi.org/10.1021/jo500616g, 2014
Liu, Liu; Wu, Yile; Wang, Tao; Gao, Xiang; Zhu, Jun; Zhao, Yufen; 汪涛; 朱军; 赵玉芬
收藏  |  浏览/下载:5/0  |  提交时间:2015/07/22
Concerted or Stepwise Mechanism? New Insight into the Water-Mediated Neutral Hydrolysis of Carbonyl Sulfide 期刊论文
http://dx.doi.org/10.1021/jp5021559, 2014
Li, Xiao-Hong; Ren, Si-Jia; Wei, Xi-Guang; Zeng, Yi; Gao, Guo-Wei; Ren, Yi; Zhu, Jun; Lau, Kai-Chung; Li, Wai-Kee; 朱军
收藏  |  浏览/下载:4/0  |  提交时间:2015/07/22
Why does activation of the weaker C=S bond in CS2 by P/N-based frustrated lewis pairs require more energy than that of the C=O bond in CO2? A DFT study 期刊论文
http://dx.doi.org/10.1021/om5009346, 2014
An, Ke; Zhu, Jun; 朱军
收藏  |  浏览/下载:6/0  |  提交时间:2015/07/22
Mechanism of Lewis-acid-catalyzed intramolecular coupling of sp(3) C-H bond and alkene: A theoretical investigation 期刊论文
http://dx.doi.org/10.1142/S0219633614500151, 2014
Ye, Miaoqiang; Liu, Rongfu; Zeng, Hui; Tan, Kai; Lu, Xin; 谭凯
收藏  |  浏览/下载:4/0  |  提交时间:2015/07/22
Hartree-Fock and density functional theory study of remote substituent effects on gas-phase heterolytic Fe-O and Fe-S bond energies of p-G-C6H4OFe(CO)(2)(eta(5)-C5H5) and p-G-C6H4SFe(CO)(2)(eta(5)-C5H5) 期刊论文
http://dx.doi.org/10.1002/poc.3252, 2014
Zeng, Qing; Li, Zucheng; Han, Daxiong; Dong, Ling; Zhai, Huaqiang; Liu, Bin; Bai, Genben; Zhang, Yujie; 韩大雄
收藏  |  浏览/下载:6/0  |  提交时间:2015/07/22
Hartree-Fock and density functional theory study of remote substituent effects on gas-phase heterolytic Fe-O and Fe-S bond energies of p-G-C 6H4OFe(CO)2(η5-C 5H5) and p-G-C6H4SFe(CO) 2(η5-C5H5) 期刊论文
http://dx.doi.org/10.1002/poc.3252, 2014
Zeng, Qi; Li, Zucheng; Han, Daxiong; Dong, Ling; Zhai, Huaqiang; Liu, Bin; Bai, Genben; Zhang, Yujie; 韩大雄
收藏  |  浏览/下载:2/0  |  提交时间:2015/07/22
邻-碳硼炔参与C-H键活化与官能化机理的理论研究 学位论文
2014, 2013
叶妙强
收藏  |  浏览/下载:2/0  |  提交时间:2016/01/14
General one-pot reductive gem-bis-alkylation of tertiary lactams/amides: Rapid construction of 1-azaspirocycles and formal total synthesis of (±)-cephalotaxine 期刊论文
http://dx.doi.org/10.1002/chem.201302096, 2013
Xiao, Kai-Jiong; Luo, Jie-Min; Xia, Xiao-Er; Wang, Yu; Huang, Pei-Qiang; 黄培强
收藏  |  浏览/下载:3/0  |  提交时间:2015/07/22
Microkinetics of steam methane reforming on platinum and rhodium metal surfaces 期刊论文
http://dx.doi.org/10.1016/j.jcat.2012.10.010, 2013
Zhu, T. W.; van Grootel, P. W.; Filot, I. A. W.; Sun, S. G.; van Santen, R. A.; Hensen, E. J. M.; 孙世刚
收藏  |  浏览/下载:1/0  |  提交时间:2013/12/12
Synthesis, spectral, and structural characterizations of imidazole oxalato molybdenum(IV/V/VI) complexes 期刊论文
http://dx.doi.org/10.1039/c2dt31566a, 2013
Chen, Quan-Liang; Chen, Hong-Bin; Cao, Ze-Xing; Zhou, Zhao-Hui; 周朝晖; 曹泽星
收藏  |  浏览/下载:3/0  |  提交时间:2013/12/12


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