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


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
Issue number23
StatePublished - Nov 1 1985

All Science Journal Classification (ASJC) codes

  • Physical and Theoretical Chemistry
  • Inorganic Chemistry


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