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Título: | Iridium complexes as catalysts in the hydrogen transfer of isopropanol to acetophenone: Ligand effects and DFT studies |
Autor: | Popoola, Saheed A.; Jaseer, E. A.; Al-Saadi, Abdulaziz A.; Polo, Víctor CSIC ORCID; Casado, Miguel A. CSIC ORCID; Oro, Luis A. CSIC ORCID | Palabras clave: | Diolefin Phosphane DFT Iridium Hydrogen transfer |
Fecha de publicación: | 2015 | Editor: | Elsevier | Citación: | Inorganica Chimica Acta 436: 146-151 (2015) | Resumen: | Methoxo-bridged diiridium complexes of the type [{Ir(μ-OMe)(diolefin)}2] (diolefin = 1,5-cyclooctadiene, tetrafluorobenzobarrelene), in the presence on P- or N-donor ligands, are active catalyst precursors in the catalytic hydrogen transfer of iPrOH to acetophenone. Both the nature of the diolefin and that of additional P- and N-donor ligands have a marked effect in the catalytic outcome of the reactions. DFT theoretical studies have been carried out on the binary catalytic systems composed of the iridium complexes and mono phosphanes (Ir/P = 1/1), which indicated that the operative mechanism in these transformations follows the classic “hydrido” route. | URI: | http://hdl.handle.net/10261/154717 | DOI: | 10.1016/j.ica.2015.07.031 | Identificadores: | doi: 10.1016/j.ica.2015.07.031 issn: 0020-1693 |
Aparece en las colecciones: | (ISQCH) Artículos |
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