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Hexafluoroisopropanol (HFIP)-prompted rearrangement of N-phenoxysulfonamides for the direct assembly of ortho-sulfonamide phenols: A combined experimental and computational study 期刊论文
TETRAHEDRON LETTERS, 2022, 卷号: 89, 页码: 5
作者:  Wang, Yi;  Chen, Xiaoli;  Lin, Shuang;  Gao, Hui;  Liu, Fu-Xiaomin;  Zhou, Zhi;  Yi, Wei
收藏  |  浏览/下载：90/0  |  提交时间：2023/11/21
N-phenoxysulfonamides  Ortho-sulfonamide phenols  Rearrangement  Hexafluoroisopropanol  DFT calculations  
Hydrogenation of biomass-derived levulinic acid to gamma-valerolactone catalyzed by PNP-Ir pincer complexes: A computational study 期刊论文
JOURNAL OF ORGANOMETALLIC CHEMISTRY, 2015, 卷号: 797, 页码: 165-170
作者:  Gao, Hui;  Chen, Jinzhu
收藏  |  浏览/下载：144/0  |  提交时间：2016/12/01
Hydrogenation  Catalytic Mechanism  Iridium  Density Functional Theory  Gamma-valerolactone  Levulinic Acid  
Selective Hydrogenation of Biomass-Based 5-Hydroxymethylfurfural over Catalyst of Palladium Immobilized on Amine-Functionalized Metal-Organic Frameworks 期刊论文
ACS CATALYSIS, 2015, 卷号: 5, 期号: 2, 页码: 722-733
作者:  Chen, Jinzhu;  Liu, Ruliang;  Guo, Yuanyuan;  Chen, Limin;  Gao, Hui
收藏  |  浏览/下载：181/0  |  提交时间：2016/11/03
Biomass  Hydrogenation  5-hydroxymethylfurfural  Palladium  Metal-organic Frameworks  
A computational study on the hydrogenation of CO2 catalyzed by a tetraphos-ligated cobalt complex: monohydride vs. dihydride 期刊论文
CATALYSIS SCIENCE & TECHNOLOGY, 2015, 卷号: 5, 期号: 2, 页码: 1006-1013
作者:  Gao, Hui;  Chen, Limin;  Chen, Jinzhu;  Guo, Yuanyuan;  Ye, Daiqi
收藏  |  浏览/下载：159/0  |  提交时间：2016/11/03
Mechanism of aquation and nucleobase binding of ruthenium (II) and osmium (II) arene complexes: A systematic comparison DFT study 期刊论文
JOURNAL OF ORGANOMETALLIC CHEMISTRY, 2012, 卷号: 704, 页码: 17-28
作者:  Wang, Hanlu;  DeYonker, Nathan J.;  Gao, Hui;  Ji, Liangnian;  Zhao, Cunyuan;  Mao, Zong-Wan
浏览  |  Adobe PDF(1802Kb)  |  收藏  |  浏览/下载：245/46  |  提交时间：2016/10/27
Dft  Ruthenium  Osmium  Aquation  Nucleobase  Pk(a)