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
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