Related Products of 288-14-2, The reaction rate of a catalyzed reaction is faster than the reaction rate of the uncatalyzed reaction at the same temperature.288-14-2, Name is Isoxazole, molecular formula is C3H3NO. In a Article，once mentioned of 288-14-2
In the present work, the molecular structures of two new synthesized dyes: (4,6-dimethylpyrimidin-2-ylamino)(5-p-tolylisoxazol-3-yl)methanol (PS-1) and N-(4,6-dimethylpyrimi-din-2-yl)-5-phenylisoxazole-3-carboxamide (PS-2), have been investigated using density functional theory (DFT) in dimethylformamide (DMF) for the first time. The electronic spectra of new dyes in a DMF solvent were carried out by time dependent density functional theory (TD-DFT) method. After quantum-chemical calculations two new dyes for the optoelectronic applications were synthesized. FT-IR spectra of the title compounds are recorded and discussed. Nucleus-Independent Chemical Shifts (NICS) calculations have also been carried out for the title compounds. The computed absorption spectral data of the title compounds are in good agreement with the experimental data, thus allowing an assignment of the UV spectra. The HOMO and LUMO molecular orbitals, excitation energies and oscillator strengths for the dyes have also been calculated and presented.
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Reference：
Isoxazole – Wikipedia,
Isoxazole | C3H3NO – PubChem