Iridium phosphinidene complexes: a comparison with iridium imido complexes in their reaction with isocyanides

J Am Chem Soc. 2009 Sep 23;131(37):13531-7. doi: 10.1021/ja9048509.

Abstract

18-Electron nucleophilic, Schrock-type phosphinidene complexes 3 [Cp*(Xy-N[triple bond]C)Ir=PAr] (Ar = Mes*, Dmp, Mes) are capable of unprecedented [1 + 2]-cycloadditions with 1 equiv of isocyanide RNC (R = Xy, Ph) to give novel iridaphosphirane complexes [Cp*(Xy-N[triple bond]C) IrPAr C=NR]. Their structures were ascertained by X-ray diffraction. Density functional theory investigations on model structures revealed that the iridaphosphirane complexes are formed from the addition of the isocyanide to 16-electron species [Cp*Ir=PAr] forming first complex 3 that subsequently reacts with another isocyanide to give the products following a different pathway than its nitrogen analogue [Cp*Ir[triple bond]Nt-Bu] 1.

Publication types

  • Comparative Study
  • Research Support, Non-U.S. Gov't

MeSH terms

  • Cyanides / chemistry*
  • Electrons
  • Imides / chemistry*
  • Iridium / chemistry*
  • Organometallic Compounds / chemistry*
  • Phosphines / chemistry*
  • Quantum Theory

Substances

  • Cyanides
  • Imides
  • Organometallic Compounds
  • Phosphines
  • Iridium