Synthesis, X-ray crystallography, vibrational spectroscopy, thermal and DFT studies of (E)-6-(4-methylstyryl)-4,5-dihydropyridazin-3(2H)-one

Journal of Molecular Structure(2021)

引用 16|浏览5
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摘要
•Novel pyridazin-3(2H)-one derivative has been synthesized and characterized using FT-IR, UV–vis, 1H- and 13C NMR, and X-ray diffraction.•Quantum chemical calculations were carried out by DFT/B3LYP method.•The Hirshfeld and MEP surfaces analyses were investigated.•The thermal stability of the synthesized compound was also studied.
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关键词
Synthesis,Pyridazin-3(2h)-one,Crystal structure DFT Hirshfeld surface,Thermal analysis
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