Guo J - Search Results

1

A DFT study unveils the secret of how H₂ is activated in the N-formylation of amines with CO₂ and H₂ catalyzed by Ru(ii) pincer complexes in the absence of exogenous additives.

Lu Y, Liu Z, Guo J, Qu S, Zhao R, Wang ZX. Lu Y, et al. Among authors: guo j. Chem Commun (Camb). 2017 Nov 7;53(89):12148-12151. doi: 10.1039/c7cc06795j. Chem Commun (Camb). 2017. PMID: 29075699

2

Unveiling Secrets of Overcoming the "Heteroatom Problem" in Palladium-Catalyzed Aerobic C-H Functionalization of Heterocycles: A DFT Mechanistic Study.

Dang Y, Deng X, Guo J, Song C, Hu W, Wang ZX. Dang Y, et al. Among authors: guo j. J Am Chem Soc. 2016 Mar 2;138(8):2712-23. doi: 10.1021/jacs.5b12112. Epub 2016 Feb 17. J Am Chem Soc. 2016. PMID: 26846963

3

Differences between the elimination of early and late transition metals: DFT mechanistic insights into the titanium-catalyzed synthesis of pyrroles from alkynes and diazenes.

Guo J, Deng X, Song C, Lu Y, Qu S, Dang Y, Wang ZX. Guo J, et al. Chem Sci. 2017 Mar 1;8(3):2413-2425. doi: 10.1039/c6sc04456e. Epub 2016 Dec 22. Chem Sci. 2017. PMID: 28451348 Free PMC article.

4

Computational mechanistic study of Ru-catalyzed CO₂ reduction by pinacolborane revealing the σ-π coupling mechanism for CO₂ decarbonylation.

Huang F, Wang Q, Guo J, Wen M, Wang ZX. Huang F, et al. Among authors: guo j. Dalton Trans. 2018 Apr 3;47(14):4804-4819. doi: 10.1039/C8DT00081F. Dalton Trans. 2018. PMID: 29561047

5

Formylation or methylation: what determines the chemoselectivity of the reaction of amine, CO₂, and hydrosilane catalyzed by 1,3,2-diazaphospholene?

Lu Y, Gao ZH, Chen XY, Guo J, Liu Z, Dang Y, Ye S, Wang ZX. Lu Y, et al. Among authors: guo j. Chem Sci. 2017 Nov 1;8(11):7637-7650. doi: 10.1039/c7sc00824d. Epub 2017 Sep 11. Chem Sci. 2017. PMID: 29568428 Free PMC article.

6

Strong Preference of the Redox-Neutral Mechanism over the Redox Mechanism for the Ti^IV Catalysis Involved in the Carboamination of Alkyne with Alkene and Diazene.

Guo J, Lu Y, Zhao R, Liu Z, Menberu W, Wang ZX. Guo J, et al. Chemistry. 2018 May 11;24(27):7010-7025. doi: 10.1002/chem.201800339. Epub 2018 Apr 30. Chemistry. 2018. PMID: 29709085

7

A strategy for developing metal-free hydrogenation catalysts: a DFT proof-of-principle study.

Liu Z , Guo J , Lu Y , Hu W , Dang Y , Wang ZX . Liu Z , et al. Among authors: guo j. Dalton Trans. 2018 Jun 12;47(23):7709-7714. doi: 10.1039/c8dt01619d. Dalton Trans. 2018. PMID: 29796513

8

A comparative DFT study of TBD-catalyzed reactions of amines with CO₂ and hydrosilane: the effect of solvent polarity on the mechanistic preference and the origins of chemoselectivities.

Zhang C , Lu Y , Zhao R , Menberu W , Guo J , Wang ZX . Zhang C , et al. Among authors: guo j. Chem Commun (Camb). 2018 Sep 25;54(77):10870-10873. doi: 10.1039/c8cc05788e. Chem Commun (Camb). 2018. PMID: 30204174

9

A Unified Mechanism to Account for Manganese- or Ruthenium-Catalyzed Nitrile α-Olefinations by Primary or Secondary Alcohols: A DFT Mechanistic Study.

Lu Y, Zhao R, Guo J, Liu Z, Menberu W, Wang ZX. Lu Y, et al. Among authors: guo j. Chemistry. 2019 Mar 12;25(15):3939-3949. doi: 10.1002/chem.201806016. Epub 2019 Feb 11. Chemistry. 2019. PMID: 30623497

10

DFT Mechanistic Account for the Site Selectivity of Electron-Rich C(sp³)-H Bond in the Manganese-Catalyzed Aminations.

Liu Z, Lu Y, Guo J, Hu W, Dang Y, Wang ZX. Liu Z, et al. Among authors: guo j. Org Lett. 2020 Jan 17;22(2):453-457. doi: 10.1021/acs.orglett.9b04215. Epub 2020 Jan 8. Org Lett. 2020. PMID: 31913046

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