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Computational Exploration of Dirhodium Complex-Catalyzed Selective Intermolecular Amination of Tertiary vs. Benzylic C−H Bonds

The mechanism and origins of site-selectivity of Rh(2)(S-tfpttl)(4)-catalyzed C(sp(3))–H bond aminations were studied using density functional theory (DFT) calculations. The synergistic combination of the dirhodium complex Rh(2)(S-tfpttl)(4) with tert-butylphenol sulfamate TBPhsNH(2) composes a pock...

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Detalles Bibliográficos
Autores principales:	Su, Xing-Xing, Chen, Xia-He, Ding, De-Bo, She, Yuan-Bin, Yang, Yun-Fang
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2023
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9959850/ https://www.ncbi.nlm.nih.gov/pubmed/36838915 http://dx.doi.org/10.3390/molecules28041928

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