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Coordination of solvent molecules to VO(acac)2 complexes in solution studied by hyperfine sublevel correlation spectroscopy and pulsed electron nuclear double resonance

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Abstract

Interactions and binding sites of the solvent molecules chloroform and ethanol to bis(acetylacetonate)oxovanadium(IV) (VO(acac)2) complexes in (frozen) solutions have been investigated by pulsed electron nuclear double resonance, sum peak electron spin echo envelope modulation and hyperfine sublevel correlation spectroscopy. The experimental proton hyperfine coupling data of coordinating solvent molecules have been interpreted using quantum chemical calculations (density functional theory). Experimental and computed hyperfine couplings indicate that ethanol coordinates to vanadium in the equatorial plane of VO(acac)2 and chloroform interacts via hydrogen bonding to oxygens of the acac ligands.

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Authors and Affiliations

  1. Fakultät für Physik und Geowissenschaften, Universität Leipzig, Linnéstrasse 5, D-04103, Leipzig, Germany

    Vijayasarathi Nagarajan & Andreas Pöppl

  2. Anorganisch-chemisches Institut, Technische Universität München, Lichtenbergstrasse 4, D-85747, Garching, Germany

    Barbara Müller, Oksana Storcheva & Klaus Köhler

Authors
  1. Vijayasarathi Nagarajan
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  2. Barbara Müller
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  3. Oksana Storcheva
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  4. Klaus Köhler
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  5. Andreas Pöppl
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Correspondence to Andreas Pöppl.

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Nagarajan, V., Müller, B., Storcheva, O. et al. Coordination of solvent molecules to VO(acac)2 complexes in solution studied by hyperfine sublevel correlation spectroscopy and pulsed electron nuclear double resonance. Res Chem Intermed 33, 705–724 (2007). https://doi.org/10.1163/156856707782169408

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  • DOI: https://doi.org/10.1163/156856707782169408

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