Identification of the Formal +2 Oxidation State of Neptunium: Synthesis and Structural Characterization of {Np[CH(SiMe)]}.

We report a new formal oxidation state for neptunium in a crystallographically characterizable molecular complex, namely Np in [K(crypt)][NpCp″] [crypt = 2.2.2-cryptand, Cp″ = CH(SiMe)]. Density functional theory calculations indicate that the ground state electronic configuration of the Np2+ ion in...

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Publicado en:Journal of the American Chemical Society Vol. 140; no. 24; pp. 7425 - 7429
Autores principales: Jing Su, Windorff, Cory J., Batista, Enrique R., Evans, William J., Gaunt, Andrew J., Janicke, Michael T., Kozimor, Stosh A., Scott, Brian L., Woen, David H., Ping Yang
Formato: Artículo
Publicado: American Chemical Society 6/20/2018
Materias:
Acceso en línea:Ver este registro en EBSCOhost
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        10.1021/jacs.8b03907
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        atl: Identification of the Formal +2 Oxidation State of Neptunium: Synthesis and Structural Characterization of {Np[CH(SiMe)]}.
      aug:
        au:
          Jing Su
          Windorff, Cory J.
          Batista, Enrique R.
          Evans, William J.
          Gaunt, Andrew J.
          Janicke, Michael T.
          Kozimor, Stosh A.
          Scott, Brian L.
          Woen, David H.
          Ping Yang
        affil:
          Theoretical Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States
          Chemistry Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States
          Department of Chemistry, University of California-Irvine, Irvine, California 92697-2025, United States
          Materials Physics and Applications Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States
      su:
        Neptunium
        Crystallography
        Electron configuration
        Oxidation states
        Density functional theory
      sug:
        subj:
          Neptunium
          Crystallography
          Electron configuration
          Oxidation states
          Density functional theory
      ab: We report a new formal oxidation state for neptunium in a crystallographically characterizable molecular complex, namely Np in [K(crypt)][NpCp″] [crypt = 2.2.2-cryptand, Cp″ = CH(SiMe)]. Density functional theory calculations indicate that the ground state electronic configuration of the Np2+ ion in the complex is 5f6d.
      pubtype: Academic Journal
      doctype: Article
      src: R
    language: English
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