Login / Signup

Donor-Stabilized Monocarba-Bridged Bis(cyclopentadienyl)alanes.

Wasim HaiderVolker HuchBernd MorgensternAndré Schäfer
Published in: ChemistryOpen (2020)
Five monocarba-bridged bis(cyclopentadienyl)aluminum halide NHC and thione complexes and one monocarba-bridged bis(cyclopentadienyl)phosphanylalane NHC complex are reported. The former were synthesized by transmetalation of a C[1]magnesocenophane with the corresponding aluminum(III) chloride and aluminum(III) bromide donor adducts. The phosphanylalane complex was obtained by a subsequent functionalization of the corresponding bromoalane with lithium diphenylphosphide. All complexes were characterized in solution by multinuclear NMR spectroscopy and in the solid state by single crystal X-ray diffraction. Bonding energies of the NHC and thione ligands to the aluminum centres were estimated by DFT calculations.
Keyphrases
  • solid state
  • density functional theory
  • ionic liquid
  • oxide nanoparticles
  • molecular dynamics
  • molecular dynamics simulations
  • mass spectrometry