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BN/BO-Ullazines and Bis-BO-Ullazines: Effect of BO Doping on Aromaticity and Optoelectronic Properties.

Yongkang GuoLei ZhangChenglong LiMengjia JinYanli ZhangJincheng YeYu ChenXiaoming WuXuguang Liu
Published in: The Journal of organic chemistry (2021)
We have achieved substitutional doping of ullazine with either two BO units or with one BO unit and one BN unit. The synthesis of these B-doped ullazines is straightforward, using demethylation and borylative cyclization as the key steps. Ullazine cores of both BN/BO-ullazines (2) and bis-BO-ullazines (3) are very close to being planar. Their electronic and photophysical properties were investigated by ultraviolet-visible, fluorescence spectroscopy, cyclic voltammetry, and density functional theory calculations.
Keyphrases
  • density functional theory
  • molecular dynamics
  • single molecule
  • ionic liquid
  • high resolution
  • mass spectrometry
  • highly efficient
  • light emitting