Molecular structure, vibrational spectral assignments, MEP, HOMO-LUMO, AIM, NCI, RDG, ELF, LOL properties of acetophenone and for its solutions based on DFT calculations
А. Jumabaev, Bekzod Khudaykulov, Utkirjon Holikulov, A. Norkulov, Jeyavijayan Subbiah, Omar M. Al-Dossary, H. Hushvaktov, Ahmad Absanov, Noureddine Issaoui
Topics & Concepts
AcetophenoneHOMO/LUMOComputational chemistryChemistryPhysical chemistryMoleculeOrganic chemistryCatalysisNonlinear Optical Materials ResearchOrganic Chemistry Cycloaddition ReactionsInorganic and Organometallic Chemistry