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The mechanism of directed Ni(ii)-catalyzed C–H iodination with molecular iodine

The density functional theory method is used to elucidate the elementary steps of Ni(ii)-catalyzed C(sp(2))–H iodination with I(2) and substrates bearing N,N′-bidentate directing centers, amide-oxazoline (AO) and 8-aminoquinoline (AQ). The relative stability of the lowest energy high- and low-spin e...

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Detalles Bibliográficos
Autores principales: Haines, Brandon E., Yu, Jin-Quan, Musaev, Djamaladdin G.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Royal Society of Chemistry 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5883947/
https://www.ncbi.nlm.nih.gov/pubmed/29675159
http://dx.doi.org/10.1039/c7sc04604a