Publications

Para‐Selective Cyanation of Arenes by H‐Bonded Template

Sandeep Pimparkar, Trisha Bhattacharya, Arun Maji, Argha Saha, Ramasamy Jayarajan, Uttam Dutta, Gang Lu*, David  W Lupton* and Debabrata Maiti*

Chem. Eur. J. 2020, DOI: 10.1002/chem.202001368.


Density Functional Theory Mechanistic Study of Ni-Catalyzed Reductive Alkyne–Alkyne Cyclodimerization: Oxidative Cyclization versus Outer-Sphere Proton Transfer

Xiaojian Ren, Yu Lu, Gang Lu* and Zhi-Xiang Wang*

Org. Lett. 2020, DOI: 10.1021/acs.orglett.0c00674.

 

Ruthenium-Catalyzed Reductive Cleavage of Unstrained Aryl–Aryl Bonds: Reaction Development and Mechanistic Study

Jun Zhu, Peng-hao Chen, Gang Lu*, Peng Liu* and Guangbin Dong*

J. Am. Chem. Soc. 2019, 141, 46, 18630–18640.


Tuning the Reactivity of Cyclopropenes from Living Ring‐Opening Metathesis Polymerization (ROMP) to Single‐Addition and Alternating ROMP

Jessica K. Su, Zexin Jin, Rui Zhang, Gang Lu, Peng Liu* and Yan Xia*

Angew. Chem. Int. Ed. 2019, 58, 17771–17776.


On The Kinetics and Inverse Temperature-Dependence of a Tsuji-Trost Reaction in Aqueous Buffer

Ivanna Pohorilets, Ivanna Pohorilets, Matthew Patrick Tracey, Michael J LeClaire, Emily M Moore, Gang Lu, Peng Liu* and Kazunori Koide*

ACS Catal. 2019, 9, 12, 11720–11733.


Chiral acid-catalysed enantioselective C−H functionalization of toluene and its derivatives driven by visible light

Fuyuan Li, Dong Tian, Yifan Fan, Richmond Lee, Gang Lu, Yanli Yin, Baokun Qiao, Xiaowei Zhao, Ziwei Xiao and Zhiyong Jiang*

Nat. Commun. 2019, 10, 1774.


Catalytic enantioselective oxidative coupling of saturated ethers with carboxylic acid derivatives

Gang Wang, Xiaodong Xin, Zehua Wang, Gang Lu, Yudao Ma and Lei Liu*

Nat. Commun. 2019, 10, 559.


Computational exploration of substrate and ligand effects in nickel-catalyzed C–Si bond carboxylation with CO2

Xiangying Lv*, Xiaotian Zhang, Rongjian Sa*, Fang Huang and Gang Lu*

Org. Chem. Front. 2019, 6, 3629–3635.


"Issues Particular to Organometallic Reactions" in "Applied Theoretical Organic Chemistry"

Gang Lu, Huiling Shao, Humair Omer and Peng Liu*

World Scientific, 2018. (Book Chapter)


A general strategy for synthesis of cyclophane-braced peptide macrocycles via palladium-catalysed intramolecular sp3 C−H arylation

Xuekai Zhang, Gang Lu, Meng Sun, Madhu Mahankali, Yanfei Ma, Mingming Zhang, Wangde Hua, Yuting Hu, Qingbing Wang, Jinghuo Chen, Gang He*, Xiangbing Qi*, Weijun Shen*, Peng Liu* and Gong Chen*

Nat. Chem. 2018, 10, 540–548.


Modular ipso/ortho Difunctionalization of Aryl Bromides via Palladium/Norbornene Cooperative Catalysis

Zhe Dong, Gang Lu, Jianchun Wang, Peng Liu* and Guangbin Dong*

J. Am. Chem. Soc. 2018, 140, 8551–8562.


H-Bonded Reusable Template Assisted para-Selective Ketonisation using Soft Electrophilic Vinyl Ethers

Arun Maji, Amit Dahiya, Gang Lu, Trisha Bhattacharya, Massimo Brochetta, Giuseppe Zanoni*, Peng Liu* and Debabrata Maiti*

Nat. Commun. 2018, 9, 3582.

         

Origin of ligand effects on reactivities of pincer-Pd catalyzed hydrocarboxylation of allenes and alkenes with formate salts: a computational study

Xiangying Lv, Fang Huang, Yan-Bo Wu and Gang Lu*

Catal. Sci. Technol. 2018, 8, 2835–2840.


Ligand-Substrate Dispersion Facilitates the Copper-Catalyzed Hydroamination of Unactivated Olefins

Gang Lu, Richard Y. Liu, Yang Yang, Cheng Fang, Daniel S. Lambrecht*, Stephen L. Buchwald* and Peng Liu*

J. Am. Chem. Soc. 2017, 139, 16548–16555.

        

Computational exploration of ligand effects in copper-catalyzed boracarboxylation of styrene with CO2

Xiangying Lv, Yan-Bo Wu and Gang Lu *

Catal. Sci. Technol. 2017, 7, 5049–5054.


Computational studies on the Rh-catalyzed carboxylation of a C(sp2)–H bond using CO2

Xiangying Lv, Linhui Zhang, Beibei Sun, Zhi Li, Yan-Bo Wu and Gang Lu*

Catal. Sci. Technol. 2017, 7, 3539–3545.


Tridentate Directing Groups Stabilize 6-Membered Palladacycles in Catalytic Alkene Hydrofunctionalization

Miriam L. O'Duill, Rei Matsuura, Yanyan Wang, Joshua L. Turnbull, John A. Gurak, Jr., De-Wei Gao, Gang Lu, Peng Liu* and Keary M. Engle*

J. Am. Chem. Soc. 2017, 139, 15576–15579.


NHC Ligands Tailored for Simultaneous Regio- and Enantiocontrol in Nickel-Catalyzed Reductive Couplings

Hengbin Wang, Gang Lu, Grant J. Sormunen, Hasnain A. Malik, Peng Liu* and John Montgomery*

J. Am. Chem. Soc. 2017, 139, 9317–9324.


Computationally-Guided Catalyst Design in the Type I Dynamic Kinetic Asymmetric Pauson−Khand Reaction of Allenyl Acetates

Lauren C. Burrows, Luke T. Jesikiewicz, Gang Lu, Steven J. Geib, Peng Liu* and Kay M. Brummond*

J. Am. Chem. Soc. 2017, 139, 15022–15032.


Computational Evidence for Lewis Base-Promoted CO2 Hydrogenation to Formic Acid on Gold Surfaces

Xiangying Lv, Gang Lu*, Zhi-Qiao Wang, Zhong-Ning Xu* and Guo-Cong Guo*

ACS Catal. 2017, 7, 4519–4526.


A Photoswitchable Olefin Metathesis Catalyst

Aaron J. Teator, Huiling Shao, Gang Lu, Peng Liu* and Christopher W. Bielawski*

Organometallics 2017, 36, 490–497.


A Ring-Opening Metathesis Polymerization Catalyst That Exhibits Redox-Switchable Monomer Selectivities

Dominika N. Lastovickova, Huiling Shao, Gang Lu, Peng Liu* and Christopher W. Bielawski*

Chem. Eur. J. 2017, 23, 5994–6000.


Catalytic activation of carbon–carbon bonds in cyclopentanones

Ying Xia, Gang Lu, Peng Liu* and Guangbin Dong*

Nature 2016, 539, 546–550.


Copper-catalyzed asymmetric addition of olefin-derived nucleophiles to ketones

Yang Yang, Ian B. Perry, Gang Lu, Peng Liu* and Stephen L. Buchwald*

Science 2016, 353, 144–150.


Benzazetidine synthesis via palladium-catalysed intramolecular C−H amination

Gang He*, Gang Lu, Zhengwei Guo, Peng Liu* and Gong Chen*

Nat. Chem. 2016, 8, 1131–1136.


Reductive Lithiation in the Absence of Aromatic Electron Carriers. A Steric Effect Manifested on the Surface of Lithium Metal Leads to a Difference in Relative Reactivity Depending on Whether the Aromatic Electron Carrier Is Present or Absent

Nicole Kennedy*, Gang Lu, Peng Liu* and Theodore Cohen*

J. Org. Chem. 2015, 80, 8571–8582.


Computational Study of Rh-Catalyzed Carboacylation of Olefins: Ligand-Promoted Rhodacycle Isomerization Enables Regioselective C–C Bond Functionalization of Benzocyclobutenones

Gang Lu, Cheng Fang, Tao Xu, Guangbin Dong and Peng Liu*

J. Am. Chem. Soc. 2015, 137, 25, 8274–8283.


Origins of Initiation Rate Differences in Ruthenium Olefin Metathesis Catalysts Containing Chelating Benzylidenes

Keary M. Engle, Gang Lu, Shao-Xiong Luo, Lawrence M. Henling, Michael K. Takase, Peng Liu*, K. N. Houk* and Robert H. Grubbs*

J. Am. Chem. Soc. 2015, 137, 5782–5792.


Gold catalyzed hydrogenations of small imines and nitriles: enhanced reactivity of Au surface toward H2 via collaboration with a Lewis base

Gang Lu, Peng Zhang, Dongqing Sun, Lei Wang, Kebin Zhou, Zhi-Xiang Wang* and Guo-Cong Guo*

Chem. Sci. 2014, 5, 1082–1090.


Manipulation of the Reducibility of Ceria‐Supported Au Catalysts by Interface Engineering

Lei Wang, Gang Lu, Dan Yang, Jin Wang, Zhibin Zhu, Zhixiang Wang and Kebin Zhou*

ChemCatChem 2013, 5, 1308–1312.


Designing Metal‐Free Catalysts by Mimicking Transition‐Metal Pincer Templates

Gang Lu#, Haixia Li#, Lili Zhao, Fang Huang, Paul von Ragué Schleyer and Zhi‐Xiang Wang* (# equal contribution)                        

Chem. Eur. J. 2011, 17, 2038–2043.


The Catalytic Role of N-Heterocyclic Carbene in a Metal-Free Conversion of Carbon Dioxide into Methanol: A Computational Mechanism Study

Fang Huang, Gang Lu, Lili Zhao, Haixia Li and Zhi-Xiang Wang*

J. Am. Chem. Soc. 2010, 132, 12388–12396.


Reversible Heterolytic Methane Activation of Metal‐Free Closed‐Shell Molecules: A Computational Proof‐of‐Principle Study

Gang Lu, Lili Zhao, Haixia Li, Fang Huang and Zhi‐Xiang Wang*

Eur. J. Inorg. Chem. 2010, 2010, 2254–2260.


Computationally Designed Metal-Free Hydrogen Activation Site: Reaching the Reactivity of Metal−Ligand Bifunctional Hydrogenation Catalysts

Gang Lu, Haixia Li, Lili Zhao, Fang Huang and Zhi-Xiang Wang*

Inorg. Chem. 2010, 49, 295–301.


Encumbering the intramolecular pi donation by using a bridge: a strategy for designing metal-free compounds to hydrogen activation

Zhi-Xiang Wang*, Gang Lu, HaiXia Li and LiLi Zhao

Chin. Sci. Bull. 2010, 55, 239–245.

 
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