姓名
郑文锐（副教授）

办公地点
工程实训中心4407

办公电话


电子邮箱
wrzheng@sues.edu.cn

毕业学校
中国科学技术大学

研究方向
1.物理有机化学
2.量子化学计算

个人简历
2019/4-2020/6 匹兹堡大学访问****
2008/7-至今 上海工程技术大学
2003/9-2008/6中国科学技术大学， 有机化学，博士
1998/9-2002/6湖北大学，化学教育，学士
承担项目
1.上海市教委优秀青年基金项目，“有机分子化学键能的理论评估”，2009-2011
2.上海工程技术大学校高培项目，“氢键在有机小分子催化中应用的理论研究”，2012-2015
荣誉奖项
2012 上海工程技术大学青年教学明星


代表性论著（论文、著作、专利）
1.Huifang Chang, Wenrui Zheng*, Yuanyuan Zheng, Danfeng Zhu, Jiaoyang Wang. The DFT study on Rh–C bond dissociation enthalpies of (iminoacyl) rhodium(III)hydride and (iminoacyl)rhodium(III)alkyl. Tetrahedron Letters2019, 60, 310-321.
2.Yuanyuan Zheng, Wenrui Zheng*,Jiaoyang Wang, Huifang Chang, Danfeng Zhu. Computational study on N?N homolytic bond dissociation enthalpies of hydrazine derivatives. J. Phys. Chem. A2018, 122, 2764?2780.
3.Jiaoyang Wang, Wenrui Zheng*, Yuanyuan Zheng. Theoretical study on homolytic B–B cleavages of diboron(4) compounds. RSC Adv. 2017, 7, 49251-49272.
4.Jiaoyang Wang, Wenrui Zheng*, Lanlan Ding, Yingxing Wang. Computational study on C–B homolytic bond dissociation enthalpies of organoboron compounds. New J. Chem., 2017, 41, 1346-1362.
5.Wenrui Zheng*, Lanlan Ding, Jiaoyang Wang, Yingxing Wang. Computational study on alkenyl/aryl C(sp²)–O homolytic cleavage of carboxylates and carbamates. RSC Adv.2016, 6, 26514-26525.
6.Yingxing Wang, Wenrui Zheng*, Lanlan Ding. The C–H Bond dissociation enthalpies in fused N-heterocyclic compounds. Russian Journal of Physical Chemistry A2016, 90(3), 610-621.
7.Lanlan Ding, Wenrui Zheng*, Yingxing Wang. Theoretical study on homolytic C(sp²)–O cleavage in ethers and phenols. NewJ. Chem., 2015, 39, 6935-6943.
8.Lanlan Ding, Wenrui Zheng*, Yingxing Wang. The homolytic C-O cleavage in phosphates and sulfonates. J. Phys. Chem. A, 2015,119, 3488-3499.
9.Yingxing Wang, Wenrui Zheng*. A comparison of the C?H bond dissociation enthalpies of sulfur-containing fused heterocyclic compounds to the C?H bond dissociation enthalpies in other heterocycles. Journal of Sulfur Chemistry, 2015, 36, 155-169.
10.Yingxing Wang, Wenrui Zheng*. A theoretical study on C–H bond dissociation enthalpies of oxygen-containing fused heterocyclic compounds. Res Chem Intermed, 2015, 41, 7207-7225.
11.Wenrui Zheng*, Wuxia Xu, Yingxing Wang, Zhichong Chen. The theoretical assessment and prediction of C-Br bond dissociation enthalpies. Computational and Theoretical Chemistry. 2014, 1027, 116-124.
12.Wenrui Zheng*, Zhichong Chen, Wuxia Xu. DFT study on homolytic dissociation enthalpies of C-I bonds.Chinese Journal of Chemical Physics, 2013, 26, 541-548.
13.Wenrui Zheng*, Zhichong Chen, Jingli Xu, Qi Yang, Tao Huang. S=O homolytic bond dissociation enthalpies in sulfones: high-level ab-initio and DFT study. Journal of Sulfur Chemistry, 2012, 33, 541-559.
14.Wenrui Zheng*, Zhiling Guo, Zhichong Chen, Qi Yang, Tao Huang. S=O homolytic bond dissociation enthalpies in sulfoxides. Res Chem Intermed, 2012,38, 1791-1806.
15.Wenrui Zheng*, Jingli Xu, Tao Huang, Zhichong Chen, Qi Yang. P=O bond dissociation enthalpies: High-levelab initioand DFT study. Computational and Theoretical Chemistry2011, 968, 1-7.
16.Wenrui Zheng*, Jingli Xu, Tao Huang, Qi Yang, Zhichong Chen. Hydrogen bonding interaction between ureas or thioureas and nitro-compounds. Res Chem Intermed2011, 37, 31-45.
17.Wenrui Zheng*, Jingli Xu, Rui Xiong. Density functional theory study on N-O bond dissociation enthalpies. Acta Phys. -Chim. Sin.2010, 26(9), 2535-2542.
18.Wenrui Zheng, Yao Fu, Lei Liu, Qingxiang Guo*. G3//BMK and its application to calculation of bond dissociation enthalpies. J. Chem. Theory Comput.2008, 4, 1324-1331.
19.Wenrui Zheng, Yao Fu, Huajing Wang, Qingxiang Guo*. C-H bond dissociation enthalpies of hydrocarbons by DFT studies. Chin. J. Org. Chem.2008, 28(3), 459-466.
20.Wenrui Zheng, Yao Fu, Kuang Shen, Lei Liu, Qingxiang Guo*. Theoretical study on hydrogen bonding interaction of ureas and thioureas with imines. Journal of Molecular Structure: THEOCHEM2007, 822, 103-110.
21.Wenrui Zheng, Yao Fu, Lei Liu, Qingxiang Guo*. Hydrogen bonding interaction between ureas or thioureas and carbonyl compounds. Acta Phys. -Chim. Sin.2007, 23(7), 1018-1024.