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Mechanistic Investigation of the Carbon–Iodine Bond Activation on the Niobium–Carbon Cluster
[Image: see text] The activation process of carbon–iodine (C–I) bond on neutral and cationic niobium metcars (Nb(8)C(12)) is investigated using density functional theory and related computational techniques. Metallocarbohedrenes or metcars are a class of stable metal–carbide clusters of specific sto...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American
Chemical Society
2017
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6644337/ https://www.ncbi.nlm.nih.gov/pubmed/31457802 http://dx.doi.org/10.1021/acsomega.7b00894 |