New insights into ESIPT mechanism of three sunscreen compounds in solution: A combined experimental and theoretical study
Feixiang Ji, Yurong Guo, Mengqi Wang, Chao Wang, Zibo Wu, Shiping Wang, Haiyuan Wang, Xia Feng, Guangjiu Zhao
Topics & Concepts
Time-dependent density functional theoryDensity functional theoryPhotochemistryChemistryIntramolecular forceMoleculeMethanolSunscreening AgentsComputational chemistryChemical physicsOrganic chemistryMedicineSkin cancerCancerInternal medicinePhotochemistry and Electron Transfer StudiesFree Radicals and AntioxidantsSpectroscopy and Quantum Chemical Studies