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Computational study on palladium-catalyzed alkenylation of remote δ-C(sp(3))–H bonds with alkynes: a new understanding of mechanistic insight and origins of site-selectivity
Palladium-catalyzed alkenylation of δ-C(sp(3))–H bonds with alkynes was conducted by density functional theory calculations. The present study shows that the dimeric Pd(2)(OAc)(4) mechanism reproduces experimental observations well, including regioselectivity and provides a deep mechanistic insight...
| Autores principales: | , , , , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
The Royal Society of Chemistry
2018
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9085394/ https://www.ncbi.nlm.nih.gov/pubmed/35546853 http://dx.doi.org/10.1039/c8ra06077k |