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Cyclic Voltammetric Study of 2‐Hydroxybenzophenone (HBP) Derivatives and the Correspondent Change in the Orbital Energy Levels in Different Solvents

Adebayo A. Adeniyi, Tankiso Lawrence Ngake, Jeanet Conradie

2020Electroanalysis71 citationsDOIOpen Access PDF

Abstract

Abstract The experimental UV and CV of five substituted 2‐hydroxybenzophenones in solvents acetonitrile, n‐dimethylformamide and dimethylsulfoxide are presented. Results obtained were used to determine their experimental highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO) and the results were compared to their theoretical model. The derivatives with an electron withdrawing group (EWG) have more favourable reduction potential, electron affinity, lower dipole moment, lower LUMO and HOMO energy levels and longer absorption λ max compared to those containing an electron donating group. Acetonitrile enhances the reduction potential especially for those of derivatives with EWG, leading to higher reduction potential compared to solvents DMF and DMSO.

Topics & Concepts

HOMO/LUMOAcetonitrileChemistryDimethylformamideMolecular orbitalDipolePolar effectCyclic voltammetryPhotochemistryElectron affinity (data page)Computational chemistryMedicinal chemistryPhysical chemistryOrganic chemistryElectrochemistrySolventMoleculeElectrodeElectrochemical Analysis and ApplicationsPhotochromic and Fluorescence ChemistryPhotochemistry and Electron Transfer Studies