Unveiling the effects of atomic electronegativity on ESIPT behaviors for FQ-OH system: A theoretical study

Dapeng Yang, Wenpeng Yang, Yanshan Tian, Jian Lv

2022Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy20 citationsDOI

Topics & Concepts

ElectronegativityExcited stateIntramolecular forceChemistryAtomic orbitalMolecular orbitalComputational chemistryChemical physicsPhotochemistryAtomic physicsElectronMoleculeStereochemistryOrganic chemistryPhysicsQuantum mechanicsPhotochemistry and Electron Transfer StudiesPorphyrin and Phthalocyanine ChemistrySpectroscopy and Quantum Chemical Studies