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Dehydrogenation reaction of triethylamine by an electrophilic terminal phosphinidene complex.

Arif Ali KhanTim KalischArturo Espinosa FeraoRainer K Streubel
Published in: Dalton transactions (Cambridge, England : 2003) (2023)
Reaction of a transiently formed terminal phosphinidene complex with triethylamine resulted in the formation of an sp 3 C-H insertion product, as revealed by 31 P NMR spectroscopy, which was isolated as semi-solid compound. However, if the reaction was continued for 24 h, a primary phosphane complex was obtained eventually. The compounds were characterised by NMR spectroscopy and mass spectrometry. Formation of the final products is explained by a mechanistic proposal based on DFT calculations.
Keyphrases
  • mass spectrometry
  • density functional theory
  • molecular dynamics
  • liquid chromatography
  • molecular dynamics simulations
  • molecular docking
  • electron transfer
  • capillary electrophoresis