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The effect of ring aromaticity on ESIPT behavior and photophysical properties of 2-(2′-hydroxyphenyl)- 4-chloromethylthiazole derivatives: A TD-DFT study

Shenyang Su, Xiuning Liang, Hua Fang

2021Journal of Molecular Liquids28 citationsDOI

Topics & Concepts

AromaticityIntramolecular forceDensity functional theoryTime-dependent density functional theoryRing (chemistry)ChemistryHeteroatomExcited stateHOMO/LUMOStokes shiftHydrogen bondPhotochemistryMoleculeComputational chemistryMaterials scienceStereochemistryLuminescenceOrganic chemistryOptoelectronicsPhysicsNuclear physicsPhotochemistry and Electron Transfer StudiesPhotochromic and Fluorescence ChemistrySynthesis and Properties of Aromatic Compounds
The effect of ring aromaticity on ESIPT behavior and photophysical properties of 2-(2′-hydroxyphenyl)- 4-chloromethylthiazole derivatives: A TD-DFT study | Litcius