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| Campo DC | Valor | Lengua/Idioma |
|---|---|---|
| dc.contributor.author | Rey Planells, Alicia | - |
| dc.contributor.author | Espinosa Ferao, Arturo Francisco | - |
| dc.contributor.author | Streubel, Rainer | - |
| dc.contributor.author | Frontera, Antonio | - |
| dc.contributor.other | Facultades, Departamentos, Servicios y Escuelas::Departamentos de la UMU::Química Orgánica | - |
| dc.date.accessioned | 2024-05-28T22:11:03Z | - |
| dc.date.available | 2024-05-28T22:11:03Z | - |
| dc.date.issued | 2024-02 | - |
| dc.identifier.citation | New Journal of Chemistry, 2024, 48, 4675–4679 | - |
| dc.identifier.issn | Print: 1144-0546 | - |
| dc.identifier.issn | Electronic: 1369-9261 | - |
| dc.identifier.uri | http://hdl.handle.net/10201/141928 | - |
| dc.description | ©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 | - |
| dc.description.abstract | 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. | - |
| dc.format | application/pdf | es_ES |
| dc.format.extent | 5 | - |
| dc.language | eng | es_ES |
| dc.publisher | Royal Society of Chemistry | - |
| dc.relation | MICIU/AEI de España (PID2020-115637GB-I00, fondos FEDER) por su apoyo financiero y la Fundación Alexander von Humboldt por el premio J. C. Mutis. | - |
| dc.rights | info:eu-repo/semantics/embargoedAccess | * |
| dc.subject | Activation of Dihydrogen | es_ES |
| dc.subject | Coulombic Assistance | es_ES |
| dc.subject | DFT calculations | es_ES |
| dc.subject | Frustrated Lewis Pair | es_ES |
| dc.title | Internal Coulombic Assistance in Intermolecular Frustrated Lewis Pair Activation of Dihydrogen | es_ES |
| dc.type | info:eu-repo/semantics/article | es_ES |
| dc.embargo.terms | Si | - |
| dc.identifier.doi | https://doi.org/10.1039/d4nj00523f | - |
| Aparece en las colecciones: | Artículos: Química Orgánica | |
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| Fichero | Descripción | Tamaño | Formato | |
|---|---|---|---|---|
| 172.-NewJC..n.pdf | 719,8 kB | Adobe PDF |  Visualizar/Abrir |
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