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Side-on coordination of diphosphorus to a mononuclear iron center

Shuai Wang, Jeffrey D. Sears, Curtis E. Moore, Arnold L. Rheingold, Michael L. Neidig, Joshua S. Figueroa

2022Science31 citationsDOIOpen Access PDF

Abstract

The diagonal relationship in the periodic table between phosphorus and carbon has set an expectation that the triple-bonded diatomic diphosphorus molecule (P 2 ) should more closely mimic the attributes of acetylene (HC≡CH) rather than its group 15 congener dinitrogen (N 2 ). Although acetylene has well-documented coordination chemistry with mononuclear transition metals, coordination complexes that feature P 2 bound to a single metal center have remained elusive. We report the isolation and x-ray crystallographic characterization of a mononuclear iron complex featuring P 2 coordination in a side-on, η 2 -binding mode. An analogous η 2 -bound bis-timethylsilylacetylene iron complex is reported for comparison. Nuclear magnetic resonance, infrared, and Mössbauer spectroscopic analysis—in conjunction with density functional theory calculations—demonstrate that η 2 -P 2 and η 2 -acetylene ligands exert a similar electronic demand on mononuclear iron centers but exhibit different reactivity profiles.

Topics & Concepts

ChemistryAcetyleneDiatomic moleculeCoordination complexReactivity (psychology)CrystallographyMoleculeTransition metalStereochemistryComputational chemistryMetalCatalysisOrganic chemistryAlternative medicinePathologyMedicineOrganometallic Complex Synthesis and CatalysisSynthesis and characterization of novel inorganic/organometallic compoundsN-Heterocyclic Carbenes in Organic and Inorganic Chemistry
Side-on coordination of diphosphorus to a mononuclear iron center | Litcius