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Metal-Free Phosphination and Continued Functionalization of Pyridine: A Theoretical Study

This study investigates the mechanism of metal-free pyridine phosphination with P(OEt)(3), PPh(3), and PAr(2)CF(3) using density functional theory calculations. The results show that the reaction mechanism and rate-determining step vary depending on the phosphine and additive used. For example, phos...

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Detalles Bibliográficos
Autores principales: Du, Pan, Yin, Yuhao, Shi, Dai, Mao, Kexin, Yu, Qianyuan, Zhao, Jiyang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9457550/
https://www.ncbi.nlm.nih.gov/pubmed/36080460
http://dx.doi.org/10.3390/molecules27175694