Browsing by Author "Fernández D."

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Molecular, vibrational and electronic structure of 4-bromo-2-halogenobenzaldehydes: Halogen and solvent effects

Fernández D.; Parlak C.; Bilge M.; Kaya M.F.; Tursun M.; Keşan G.; Şenyel M. (De Gruyter, 2019)

The halogen and solvent effects on the structure of 4-bromo-2-halogenobenzaldehydes [C7H4BrXO; X = F (BFB), Cl (BCB) or Br (BBB)] were investigated by the density functional theory (DFT) and time-dependent density functional ...