深圳市计算化学与药物设计重点实验室
Lab of Computational Chemistry and Drug Design

Maoping Pu

时间:2020-01-05

 

蒲茂坪  Maoping Pu   副研究员

https://orcid.org/0000-0002-0745-9549

 

Education & Work:

2019/09- present 副研究员, Schenzhen Bay Laboratory
2016/08- 2019/07 Postdoc, RWTH Aachen, Germany
2011/12- 2016/01 Doctor of Philosophy in Chemistry, Stockholm University, Stockholm, Sweden.
2008/09-2011/ 07 Master of Science in Physical Chemistry, South China Normal University, Guangzhou.
2004/09-2008/06 Bachelor of Science in Chemistry, Huazhong Agricultural University, Wuhan, China.

 

Publications:

16.

 

Cheng, H.-G., Pu, M., Kundu, G., Schoenebeck, F. Selective Methylation of Amides, N-Heterocycles, Thiols, and Alcohols with Tetramethylammonium Fluoride. Org. Lett. 2019, DOI: 10.1021/acs.orglett.9b04400.
15.

 

Chen, X.; Pu, M.; Cheng, H.; Sperger, T.; Schoenebeck, F. Arylation of Axially Chiral Phosphorothioate Salts via Dinuclear Pd(I) Catalysis, Angew. Chem. Int. Ed. 2019.58.11395.
14.

 

Pu, M.; Sanhueza, I.; Senol, E.; Schoenebeck, F. Divergent Reactivity of Stannane versus Silane in the Trifluoromethylation of Pd(II) - Cyclic Transition State vs. Difluorocarbene Release. Angew. Chem. Int. Ed. 2018, 57, 15081-1508.
13.

 

Scattolin, T.; Pu, M.; Schoenebeck, F. Investigation of (Me4N)SCF3 as a solid, stable & safe reservoir for the autocatalytic access to S=CF2 as a surrogate for thiophosgene. Chem. Eur. J. 2018, 24, 567.
12.

 

 

Pu, M.; Heshmat, M.; Privalov, T. Liberation of H2 from (o-C6H4Me)3P-H+H-B(p-C6F4H)3 ion-pair: A transition-state in the minimum energy path versus the transient species in Born-Oppenheimer molecular dynamics. J. Chem. Phys. 2017. 147, 014303.
11.

 

Pu, M.; Privalov, T. ab initio molecular dynamics with explicit solvent discovers a two-step pathway in the Frustrated Lewis Pair reaction. Chem. Eur. J. 2015, 21, 17708.
10. Pu, M.; Privalov, T. Chemistry of  intermolecular frustrated Lewis pairs in motion: emerging perspectives and prospects, Isr. J. Chem, 2015, 55, 179.
9. Pu, M.; Privalov, T. “Ab initio molecular dynamics study of hydrogen cleavage by [tBu3P] and [B(C6F5)3] at mesoscopic level,” ChemPhysChem. 2014. 15, 3714.
8.

 

Pu, M.; Privalov, T. “How frustrated Lewis acid/base system pass through transition-state region: H2 cleavage by tBu3P/B(C6F5)3,” ChemPhysChem. 2014. 15, 2936.
7.

 

 

Pu, M.; Privalov, T. “Uncovering the role of intra- and intermolecular motion in frustrated Lewis acid/base chemistry: ab initio molecular dynamics study of CO2 binding by phosphorus/boron frustrated Lewis pair [tBu3P/B(C6F5)3],” Inorg. Chem. 2014, 53, 4598.
6. Pu, M.; Privalov, T. “Multiple-pathway of carbon dioxide binding by [B(C6F5)3] and [tBu3P]: the energy landscape perspective,” Int. J. Quan. Chem. 2014, 114, 289.
5.

 

Pu, M.; Privalov, T. “Binding of CO2 by a Mes2PCH2CH2B(C6F5)2 species: an involvement of the ground state species in a low-energy pathway,” Chem. Eur. J. 2013, 19, 16512.
4.

 

Pu, M.; Privalov, T. Ab initio dynamics trajectory study of the heterolytic cleavage of H2 by a Lewis acid [B(C6F5)3] and a Lewis base [P(tBu)3]. J. Chem. Phys. 2013. 138, 154305.
3.

 

Wang, L.; Duan, L.; Stewart, B.; Pu, M.; Liu, J.; Privalov, T.; Sun, L. Toward Controlling Water Oxidation Catalysis: Tunable Activity of Ruthenium Complexes with Axial Imidazole/DMSO Ligands. J. Am. Chem. Soc. 2012, 134, 18868.
2.

 

Pu, M.; Peng, B.; Li, Q.; Xie, Y.; King, R. B. Binuclear allyliron carbonyls: Fragile dimmers and diverse types of allyl groups. Polyhedron, 2012, 48, 131.
1.

 

Pu M., Li Q. S., Xie Y. M., King R. B., Schaefer H. F. Mononuclear Homoleptic Allyl Complexes of the First Row Transition Metals: Species with Unusual Metal Electronic Configurations. J. Phys Chem A 2011, 115, 4491.