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Mechanism, reactivity, and selectivity of the iridium-catalyzed C(sp(3))–H borylation of chlorosilanes
The iridium-catalyzed C(sp(3))–H borylation of methylchlorosilanes is investigated by means of density functional theory, using the B3LYP and M06 functionals. The calculations establish that the resting state of the catalyst is a seven-coordinate Ir(v) species that has to be converted into an Ir(iii...
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| Publicado no: | Chem Sci |
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| Main Authors: | , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Royal Society of Chemistry
2015
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5644124/ https://ncbi.nlm.nih.gov/pubmed/29163873 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c4sc01592d |
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