Quantum-chemical modeling, spectroscopic (FT-IR, excited states, UV/Vis, polarization, and Dichroism) studies of two new benzo[d]oxazole derivatives
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DOI: 10.1016/j.molstruc.2019.127352
Abstract: Abstract In the given research, the molecular structures of the two new benzo[d]oxazole derivatives including H-1 and H-2: have been studied with the use of density functional theory (DFT/B3LYP and M062X) in dimethylformamide (DMF) for… read more here.
Keywords: quantum chemical; chemical modeling; benzo oxazole; two new ... See more keywords