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Bidentate Boron Lewis Acids: Selectivity in Host-Guest Complex Formation.

Philipp NiermeierSebastian BlomeyerYounes K J BejaouiJ Louis BeckmannBeate NeumannHans-Georg StammlerNorbert W Mitzel
Published in: Angewandte Chemie (International ed. in English) (2019)
Bidentate boron Lewis acids based on 1,8-diethynylanthracene were synthesised in two steps by initial stannylation of the terminal alkynes and subsequent tin-boron exchange with different chloroboranes. The reactions were very selective, and the target compounds were obtained in high purity and good to excellent yields. Complexation experiments of 1,8-bis[(diphenylboranyl)ethynyl]anthracene with nitrogen bases (pyridine, pyrimidine, TMEDA) afforded three stable adducts, which were structurally characterised by X-ray diffraction. Competition experiments demonstrated the selective exchange of guests, and quantum-chemical calculations provided information on their energetics. NMR experiments at low temperature gave insight into the dynamic behaviour of the TMEDA adduct.
Keyphrases
  • high resolution
  • molecular dynamics
  • magnetic resonance
  • density functional theory
  • molecular dynamics simulations
  • healthcare
  • solid state
  • computed tomography
  • quantum dots
  • energy transfer