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    Formation of a σ-alkane complex and a molecular rearrangement in the solid-State: [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF 4]


    McKay, Alasdair I. and Krämer, Tobias and Rees, Nichollas H. and Thompson, Amber L. and Christensen, Kirsten E. and Macgregor, Stuart A. and Weller, Andrew S. (2017) Formation of a σ-alkane complex and a molecular rearrangement in the solid-State: [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF 4]. Organometallics, 36 (1). pp. 22-25. ISSN 0276-7333

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    Abstract

    Addition of H2 to the precursor [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H8)][BArF4] gives the σ-alkane complex [Rh(Cyp2PCH2CH2PCyp2)(η2:η2-C7H12)][BArF4] by a single-crystal to single-crystal reaction, as characterized by X-ray crystallography, SSNMR spectroscopy, and periodic DFT. An unexpected rearrangement of the {Rh(L2)}+ fragment is revealed.

    Item Type: Article
    Keywords: Paraffins; Molecular rearrangement; Periodic DFT; Single crystal-to-single crystal reactions; Single crystals;
    Academic Unit: Faculty of Science and Engineering > Chemistry
    Item ID: 11592
    Identification Number: https://doi.org/10.1021/acs.organomet.6b00645
    Depositing User: Tobias Krämer
    Date Deposited: 04 Nov 2019 14:42
    Journal or Publication Title: Organometallics
    Publisher: American Chemical Society
    Refereed: Yes
    URI:

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