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| Título: | Internal Coulombic Assistance in Intermolecular Frustrated Lewis Pair Activation of Dihydrogen |
| Fecha de publicación: | feb-2024 |
| Editorial: | Royal Society of Chemistry |
| Cita bibliográfica: | New Journal of Chemistry, 2024, 48, 4675–4679 |
| ISSN: | Print: 1144-0546 Electronic: 1369-9261 |
| Palabras clave: | Activation of Dihydrogen Coulombic Assistance DFT calculations Frustrated Lewis Pair |
| Resumen: | 1,3-Zwitterions consisting of a phosphonium cation linked to a silicate centre through a one-atom bridge, X3P–E–SiY4 (3), are computationally studied. Their phosphonium acidic group together with a Lewis base constitute a frustrated Lewis pair (FLP) in the activation of H2, with the silicate side-arm providing Coulombic stabilization to the positive charge at the Lewis base. |
| Autor/es principal/es: | Rey Planells, Alicia Espinosa Ferao, Arturo Francisco Streubel, Rainer Frontera, Antonio |
| Facultad/Departamentos/Servicios: | Facultades, Departamentos, Servicios y Escuelas::Departamentos de la UMU::Química Orgánica |
| URI: | http://hdl.handle.net/10201/141928 |
| DOI: | https://doi.org/10.1039/d4nj00523f |
| Tipo de documento: | info:eu-repo/semantics/article |
| Número páginas / Extensión: | 5 |
| Derechos: | info:eu-repo/semantics/embargoedAccess |
| Descripción: | ©The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2024. This document is the Published version of a Published Work that appeared in final form in New Journal of Chemistry. To access the final edited and published work see https://doi.org/10.1039/d4nj00523f |
| Aparece en las colecciones: | Artículos: Química Orgánica |
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| 172.-NewJC..n.pdf | 719,8 kB | Adobe PDF |  Visualizar/Abrir |
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