Bonding in Nitrosylated Iron-Sulfur Clusters

Shen Shu Sung, Anthony R. Butler, Christopher Glidewell, Roald Hoffmann

    Research output: Contribution to journalArticlepeer-review

    42 Scopus citations

    Abstract

    The electronic structure of several binuclear and tetranuclear Fe clusters with bridging S or SH units and terminal nitrosyl ligands is analyzed. The computations point to the antibonding nature of the lowest unoccupied orbitals of these molecules, indicative of potential disruption of the clusters on reduction.

    Original languageEnglish (US)
    Pages (from-to)3856-3859
    Number of pages4
    JournalInorganic chemistry
    Volume24
    Issue number23
    DOIs
    StatePublished - Nov 1 1985

    All Science Journal Classification (ASJC) codes

    • Physical and Theoretical Chemistry
    • Inorganic Chemistry

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