Detalhe da pesquisa
1.
Revealing the Mechanistic Features of an Electrosynthetic Catalytic Reaction and the Role of Redox Mediators through DFT Calculations and Microkinetic Modeling.
Chemphyschem
; : e202400402, 2024 May 13.
Artigo
em Inglês
| MEDLINE | ID: mdl-38739104
2.
Comprehensive Mechanistic Scenario for the Cu-Mediated Asymmetric Propargylic Sulfonylation Forging Tertiary Carbon Stereocenters.
J Am Chem Soc
; 145(11): 6442-6452, 2023 Mar 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-36883980
3.
Generating Fischer-Type Rh-Carbenes with Rh-Carbynoids.
J Am Chem Soc
; 145(9): 4975-4981, 2023 Mar 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-36812070
4.
Introducing the Catalytic Amination of Silanes via Nitrene Insertion.
J Am Chem Soc
; 144(23): 10608-10614, 2022 06 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-35648453
5.
Seeking the Optimal Descriptor for SN2 Reactions through Statistical Analysis of Density Functional Theory Results.
J Org Chem
; 87(1): 363-372, 2022 Jan 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-34935370
6.
Two Copper-Carbenes from One Diazo Compound.
J Am Chem Soc
; 143(12): 4837-4843, 2021 03 31.
Artigo
em Inglês
| MEDLINE | ID: mdl-33733762
7.
An Expanded SET Model Associated with the Functional Hindrance Dominates the Amide-Directed Distal sp3 C-H Functionalization.
J Am Chem Soc
; 143(46): 19406-19416, 2021 11 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-34761900
8.
Redefining the Mechanistic Scenario of Carbon-Sulfur Nucleophilic Coupling via High-Valent Cp*CoIV Species.
Angew Chem Int Ed Engl
; 60(20): 11217-11221, 2021 05 10.
Artigo
em Inglês
| MEDLINE | ID: mdl-33739577
9.
Intermolecular Allene Functionalization by Silver-Nitrene Catalysis.
J Am Chem Soc
; 142(30): 13062-13071, 2020 07 29.
Artigo
em Inglês
| MEDLINE | ID: mdl-32590895
10.
Photosynthesis of a Dihydroimidazopyridine Chelate Shines Light on the Reactions of a Photoactivated Iron(III) Complex with O2.
Inorg Chem
; 59(22): 16281-16290, 2020 Nov 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-33021370
11.
A Quantitative Model for Alkane Nucleophilicity Based on C-H Bond Structural/Topological Descriptors.
Angew Chem Int Ed Engl
; 59(8): 3112-3116, 2020 Feb 17.
Artigo
em Inglês
| MEDLINE | ID: mdl-31826300
12.
GARLEEK: Adding an extra flavor to ONIOM.
J Comput Chem
; 40(2): 381-386, 2019 01 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-30462350
13.
Exploring the Role of Coinage Metalates in Trifluoromethylation: A Combined Experimental and Theoretical Study.
Chemistry
; 25(40): 9390-9394, 2019 Jul 17.
Artigo
em Inglês
| MEDLINE | ID: mdl-30714647
14.
Enantioselective Synthesis of 3-Heterosubstituted-2-amino-1-ols by Sequential Metal-Free Diene Aziridination/Kinetic Resolution.
Chemistry
; 25(54): 12628-12635, 2019 Sep 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-31283057
15.
On the Use of Thermodynamic Cycles for the Calculation of Standard Potentials for the Oxidation of Solid Metals in Solution.
Chemphyschem
; 20(1): 159-162, 2019 01 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-30421482
16.
Four Oxidation States in a Single Photoredox Nickel-Based Catalytic Cycle: A Computational Study.
Angew Chem Int Ed Engl
; 58(12): 3898-3902, 2019 Mar 18.
Artigo
em Inglês
| MEDLINE | ID: mdl-30675986
17.
Copper-Catalyzed N-F Bond Activation for Uniform Intramolecular C-H Amination Yielding Pyrrolidines and Piperidines.
Angew Chem Int Ed Engl
; 58(26): 8912-8916, 2019 Jun 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-30997949
18.
A Domino Process toward Functionally Dense Quaternary Carbons through Pd-Catalyzed Decarboxylative C(sp3)-C(sp3) Bond Formation.
J Am Chem Soc
; 140(11): 3981-3987, 2018 03 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-29337542
19.
Photoinduced O2-Dependent Stepwise Oxidative Deglycination of a Nonheme Iron(III) Complex.
J Am Chem Soc
; 140(43): 14150-14160, 2018 10 31.
Artigo
em Inglês
| MEDLINE | ID: mdl-30347152
20.
Computational Characterization of the Mechanism for the Oxidative Coupling of Benzoic Acid and Alkynes by Rhodium/Copper and Rhodium/Silver Systems.
Chemistry
; 24(47): 12383-12388, 2018 Aug 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-29528147