The dipnictenes R-E=E′-R′ (E=P, As, Sb, Bi) revisited: a TDDFT and multi-reference study of some aspects of its electronic spectroscopy

Compounds with double bonds Terp-E=E′-Terp (E, E'=P, As, Sb or Bi; Terp=-C6H3-2,6 (C6H5)2) have been studied using DFT. These compounds have been used as a model for other compounds with larger substituents. Some bands of its electronic spectroscopy have been calculated using TDDFT, and the results ... View More