Synthesis, characterization, computational, excited state properties, wave function and molecular docking studies of (E)-1-(perfluorophenyl)-N-(p-tolyl) methanimine
J. Geethapriya, A. Shanthidevi, M. Arivazhagan, N. Elangovan, S. Sowrirajan, S. Manivel, Renjith Thomas
Topics & Concepts
ChemistryNatural bond orbitalADMEComputational chemistryDensity functional theoryMoleculeMolecular orbitalHOMO/LUMOIonization energyExcited stateDocking (animal)Implicit solvationSolvationChemical physicsIonizationOrganic chemistryAtomic physicsMedicineIn vitroIonNursingBiochemistryPhysicsFree Radicals and AntioxidantsNonlinear Optical Materials ResearchPhotochemistry and Electron Transfer Studies