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. 2021 Apr 2;26(7):2039. doi: 10.3390/molecules26072039
CT Charge transfer
KT Ketotifen Fumarate
DDQ 2,3-dichloro-5,6-dicyano-p-benzoquinone
TCNQ 7,7,8, 8-tetracyanoquinodimethane
DFT density functional theory
f oscillator strength
μ transition dipole moment
Ip ionization potentials
ECT energy of charge transfer complex
W dissociation energy
ΔG Gibbs free energy
RN Resonance energy
ε extinction coefficient
MEP molecular electrostatic potential
HOMO highest occupied molecular orbital
LUMO lowest unoccupied molecular orbital