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Copper-Catalyzed Enantioselective C-H Arylation between 2-Arylindoles and Hypervalent Iodine Reagents.

Hao LiangGuoxun ZhuXiaoyun PuLiqin Qiu
Published in: Organic letters (2021)
The copper-catalyzed enantioselective C-H arylation between 2-arylindoles and hypervalent iodine reagents has been successfully developed, which provides a convenient and economical route to the highly atroposelective synthesis of axially chiral indole derivatives with a 2-aryl structure (up to 99% ee). Density functional theory calculations and wave function analysis show that the key "sandwich" intermediate leads to high enantioselectivity of the reaction.
Keyphrases
  • density functional theory
  • molecular dynamics
  • dual energy
  • magnetic resonance imaging
  • magnetic resonance
  • electron transfer
  • monte carlo