Molecular structure, vibrational spectral assignments, HOMO-LUMO, MESP, Mulliken analysis and thermodynamic properties of 2,6-xylenol and 2,5-dimethyl cyclohexanol based on DFT calculation
Keywords: 2،6-کزیلنول; 2,6-Xylenol; 2,5-Dimethyl cyclohexanol; DFT calculations; MESP;