王永 - 中国科学院兰州化学物理研究所 - 羰基合成与选择氧化国家重点实验室

个人简介

1995年9月—1999年7月，安徽大学，学士，应用物理专业； 1999年9月—2002年7月，河南师范大学，硕士，原子与分子物理专业； 2002年9月—2007年5月，大连化学物理研究所，博士，物理化学专业； 2007年6月—2009年9月，以色列耶路撒冷希伯来大学（Hebrew University of Jerusalem），博士后，计算化学专业； 2009年9月—至今，大连化学物理研究所，副研究员，项目骨干； 2011年10月-2011年10月，香港大学访问学者； 2014年9月—2014年9月，新加坡南洋理工大学访问学者； 2011年10月—至今，香港“Global Science Press”出版社发行的《Communications in Computational Chemistry》杂志执行编辑（Managing Editor）

研究领域

一、羰基合成基于一氧化碳/二氧化碳的催化羰化反应；基于甲醛、甲醇的催化羰化反应；非传统羰源的羰基合成反应研究。二、选择氧化低碳烃的选择氧化和定向转化；仿生催化选择氧化；新型选择氧化反应研究。

近期论文

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X. B. Wang, J. W. Chen, Y. Wang, H. B. Xie, Z. Q. Fu, Transformation pathways of MeO-PBDEs catalyzed by active center of P450 enzymes: A DFT investigation employing 6-MeO-BDE-47 as a case, Chemosphere, 2015, 120, 631. X. Q. Zhang, Y. F. Liu*, Y. Wang*, The influence of the adjacent hydrogen bond on the hydroxylation processes mediated by cytochrome P450 side-chain cleavage enzyme. Theor. Chem. Acc. 2014. 133, 1485. S. Hong, F. F. Pfaff, E. Kwon, Y. Wang, M.S. Seo, E. Bill, K. Ray, W. Nam, Spectroscopic Capture and Reactivity of a Low-Spin Cobalt(IV)-Oxo Complex Stabilized by Binding Redox-Inactive Metal Ions, Angew. Chem. Int. Ed. 2014, 53, 10403. X. X. Li, Q. C. Zheng*, Y. Wang*, H. X. Zhang, Theoretical insights into the reductive metabolism of CCl4 by cytochrome P450 enzymes and the CCl4-dependent suicidal inactivation of P450, Dalton Trans. 2014, 43, 14833. W. N. Oloo, K. K. Meier, Y. Wang, S. Shaik, E. Munck, L, Que, Jr., Identification of a low-spin acylperoxoiron(III) intermediate in bio-inspired non-heme iron-catalysed oxidations, Nat. Commun. 2014, 5, 3046. Y. Wang*, D. Janardanan, D. Usharani, K. L. Han, L. Que, Jr.*, S. Shaik*, Nonheme Iron Oxidant Formed in the Presence of H2O2 and Acetic Acid Is the Cyclic Ferric Peracetate Complex, Not a Perferryloxo Complex, ACS Catal. 2013, 3, 1334. D. M. Li, Y. Wang, K. L. Han, Recent density functional theory model calculations of drug metabolism by cytochrome P450, Coord. Chem. Rev. 2012, 256, 1137. X. B. Wang, Y. Wang, J. W. Chen, Y. Q. Ma, J. Zhou, Z. Q. Fu, Computational Toxicological Investigation on the Mechanism and Pathways of Xenobiotics Metabolized by Cytochrome P450: A Case of BDE-47, Environ. Sci. Technol. 2012, 46, 5126. P. Schyman, W. Z. Lai, H. Chen, Y. Wang, S. Shaik, The Directive of the Protein: How Does Cytochrome P450 Select the Mechanism of Dopamine Formation? J. Am. Chem. Soc. 2011, 133, 7977. S. Shaik, S. Cohen, Y. Wang, H. Chen, D. Kumar, W. Thiel, P450 Enzymes: Their Structure, Reactivity and Selectivity, Modeled by QM/MM Calculations, Chem. Rev. 2010, 110, 949. S. Shaik, W. Z. Lai, H. Chen, Y. Wang, The Valence Bond Way: Reactivity Patterns of Cytochrome P450 Enzymes and Synthetic Analogs, Acc. Chem. Res. 2010, 43, 1154. J. Deepa, Y. Wang, P. Schyman, L. Que, Jr., S. Shaik, Fundamental Role of Exchange- Enhanced Reactivity in C-H Activation in S=2 Oxoiron(IV) Complexes, Angew. Chem. Int. Ed. 2010, 49, 3342. Y. Wang, D. M. Li, K. L. Han, S. Shaik, An Acyl Group Makes a Difference in the Reactivity Patterns of Cytochrome P450 Catalyzed N-Demethylation of Substituted N,N-Dimethylbenzamides—High Spin Selective Reactions, J. Phys. Chem. B 2010, 114, 2964. D. M. Li, Y. Wang, K. L. Han, C. G. Zhan, Fundamental Reaction Pathways for Cytochrome P450-Catalyzed 5'-Hydroxylation and N-Demethylation of Nicotine, J. Phys. Chem. B 2010, 114, 9023. P. Schyman, D. Usharani, Y. Wang, S. Shaik, Brain Chemistry: How Does P450 Catalyze the O-Demethylation Reaction of 5-Methoxytryptamine to Yield Serotonin? J. Phys. Chem. B 2010, 114, 7078. Y. Wang, H. Chen, M. Makino, Y. Shiro, S. Nagano, S. Asamizu, H. Onaka, S. Shaik, Theoretical and Experimental Studies of the Conversion of Chromopyrrolic Acid to an Antitumor Derivative by Cytochrome P450 StaP: The Catalytic Role of Water Molecules, J. Am. Chem. Soc. 2009, 131, 6748. S. Shaik, Y. Wang, H. Chen, J. S. Song, R. Meir, Valence Bond Modelling and Density Functional Theory Calculations of Reactivity and Mechanism of Cytochrome P450 Enzymes: Thioether Sulfoxidation, Faraday Discuss. 2009, 145, 49. Y. Wang, Y. Wang, K. L. Han, Theoretical study of cyclohexane hydroxylation by three possible isomers of [FeIV(O)(R-TPEN)]2+: does the pentadentate ligand wrapping around the metal center differently lead to the different stability and reactivity? J. Biol. Inorg. Chem. 2009, 13, 553. D. M. Li, Y. Wang, C. L. Yang, K. L. Han, Theoretical study of N-dealkylation of N-cyclopropyl-N-methylaniline catalyzed by cytochrome P450: insight into the origin of the regioselectivity, Dalton Trans., 2009, 291. I. I. Ebralidze, G. Leitus, L. J. W. Shimon, Y. Wang, S. Shaik, R. Neumann, Structural variability in manganese(II) complexes of N,N'-bis(2-pyridinylmethylene) ethane (and propane) diamine ligands, Inorg. Chim. Acta 2009, 362, 4713.