Non-Metal-Catalyzed Heterodehydrocoupling of Phosphines and Hydrosilanes: Mechanistic Studies of B(CF)-Mediated Formation of P-Si Bonds.

Non-metal-catalyzed heterodehydrocoupling of primary and secondary phosphines (RRPH, R = H or R) with hydrosilanes (RRRSiH, R, R = H or R) to produce synthetically useful silylphosphines (RRP-SiRRR) has been achieved using B(CF) as the catalyst (10 mol %, 100 °C). Kinetic studies demonstrated that t...

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Publicado en:Journal of the American Chemical Society Vol. 139; no. 46; pp. 16780 - 16791
Autores principales: Lipeng Wu, Chitnis, Saurabh S., Haijun Jiao, Annibale, Vincent T., Manners, Ian
Formato: Artículo
Publicado: American Chemical Society 11/22/2017
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Acceso en línea:Ver este registro en EBSCOhost
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      dt: 11/22/2017
      vid: 139
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      pub: American Chemical Society
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        10.1021/jacs.7b09175
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        atl: Non-Metal-Catalyzed Heterodehydrocoupling of Phosphines and Hydrosilanes: Mechanistic Studies of B(CF)-Mediated Formation of P-Si Bonds.
      aug:
        au:
          Lipeng Wu
          Chitnis, Saurabh S.
          Haijun Jiao
          Annibale, Vincent T.
          Manners, Ian
        affil:
          School of Chemistry, University of Bristol, Cantock s Close, Bristol, BS8 1TS, United Kingdom
          Leibniz-Institut fur Katalyse e. V., Albert-Einstein-Straße 29a, 18059 Rostock, Germany
      su:
        Phosphines
        Silane
        Chemical reactions
        Density functional theory
        Chemical bonds
        Nucleophilic reactions
      sug:
        subj:
          Phosphines
          Silane
          Chemical reactions
          Density functional theory
          Chemical bonds
          Nucleophilic reactions
      ab: Non-metal-catalyzed heterodehydrocoupling of primary and secondary phosphines (RRPH, R = H or R) with hydrosilanes (RRRSiH, R, R = H or R) to produce synthetically useful silylphosphines (RRP-SiRRR) has been achieved using B(CF) as the catalyst (10 mol %, 100 °C). Kinetic studies demonstrated that the reaction is first-order in hydrosilane and B(CF) but zero-order in phosphine. Control experiments, DFT calculations, and DOSY NMR studies suggest that a RRHP•B(CF) adduct is initially formed and undergoes partial dissociation to form an "encounter complex". The latter mediates frustrated Lewis pair type Si-H bond activation of the silane substrates. We also found that B(CF) catalyzes the homodehydrocoupling of primary phosphines to form cyclic phosphine rings and the first example of a non-metal-catalyzed hydrosilylation of P-P bonds to produce silylphosphines (RRP-SiRRR). Moreover, the introduction of PhCN to the reactions involving secondary phosphines with hydrosilanes allowed the heterodehydrocoupling reaction to proceed efficiently under much milder conditions (1.0 mol % B(CF) at 25 °C). Mechanistic studies, as well as DFT calculations, revealed that PhCN plays a key mechanistic role in facilitating the dehydrocoupling reactions rather than simply functioning as H-acceptor.
      pubtype: Academic Journal
      doctype: Article
      src: R
    language: English
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          year: 2017
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