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Solid state frustrated Lewis pair chemistry.

Long WangGerald KehrConstantin Gabriel DaniliucMelanie BrinkkötterThomas WiegandAnna-Lena WübkerHellmut EckertLei LiuJan Gerit BrandenburgStefan GrimmeGerhard Erker
Published in: Chemical science (2018)
In solution the PCy3/B(C6F5)3 pair is rapidly deactivated by nucleophilic aromatic substitution. In the solid state deactivation is effectively suppressed and the active frustrated phosphane/borane Lewis pair splits dihydrogen or adds to sulfur dioxide. A variety of phosphane/B(C6F5)3 pairs have been used to carry out active FLP reactions in the solid state. The reactions were analyzed by DFT calculations and by solid state NMR spectroscopy. The solid state dihydrogen splitting reaction was also carried out under near to ambient conditions with suspensions of the non-quenched phosphane/borane mixtures in the fluorous liquid perfluoromethylcyclohexane.
Keyphrases
  • solid state
  • density functional theory
  • ionic liquid
  • air pollution
  • molecular dynamics
  • molecular docking
  • monte carlo
  • electron transfer