№ files_lp_3_process_9_27940
Research article in organic chemistry reporting an experimental and computational investigation of Pd(II)–NHC-catalyzed acyl Buchwald-Hartwig cross-coupling of amides via selective N–C(O) bond cleavage, including catalyst evaluation and mechanistic analysis.
Year: 20xx
DOI: 10.1039/x0xx00000x
Type of document: Research article
Field: Organic chemistry
Subfield: Catalysis and cross-coupling reactions
Keywords: Buchwald-Hartwig cross-coupling, transamidation, amide bond activation, Pd–NHC precatalysts, N–C(O) cleavage, DFT study
Authors: Guangchen Li; Tongliang Zhou; Èric Casals-Cruañas; Albert Poater; Luigi Cavallo; Steven P. Nolan; Michal Szostak
Corresponding authors: Albert Poater; Steven P. Nolan; Michal Szostak
Affiliations: Department of Chemistry, Rutgers University; Institut de Química Computacional i Catàlisi and Departament de Química, Universitat de Girona; King Abdullah University of Science & Technology (KAUST Catalysis Center); Department of Chemistry, Ghent University
Supplementary material: Electronic Supplementary Information (ESI) available (experimental details and computational data)
Methodology: Experimental catalysis and density functional theory (DFT) calculations
Catalyst systems studied: Pd(II)–NHC precatalysts including [Pd(NHC)(allyl)Cl] complexes and chloro-dimers
Reaction type: Acyl-type Buchwald-Hartwig cross-coupling of amides
Price: 8 / 10 USD
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