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Single-crystal X-ray diffraction study of novel pyrazole chalcone derived from 1-phenyl-3-p-tolyl-1H-pyrazole-4-carbaldehyde
Indian Journal of Chemistry, Section B Pub Date : 2020-01-14
Anita R Banpurkar, Sachin S Wazalwar, Franc Perdih

Novel pyrazole chalcone has been synthesized by reaction of phenyl-3-p-tolyl-1H-pyrazole-4-carbaldehyde and acetophenone by Claisen-Schmidt reaction in ethanol by microwave assisted method. It has been characterized by elemental analysis and spectroscopic (FTIR, 1H NMR and MS) studies. Crystal structure of the compound has been determined using single-crystal X-ray diffraction. Hydrogen-bonded chain is formed by C–H···O bonding enhanced by C–H···π interaction. Adjacent chains are connected through the π∙∙∙π interactions.

中文翻译:

1-苯基-3-对甲苯基-1H-吡唑-4-甲醛的新型吡唑查尔酮的单晶X射线衍射研究

微波辅助法在乙醇中通过克莱森-施密特反应使苯基-3-甲苯基-1 H-吡唑-4-甲醛与苯乙酮反应合成了新型吡唑查尔酮。它已通过元素分析和光谱学(FTIR,1 H NMR和MS)研究进行了表征。该化合物的晶体结构已经使用单晶X射线衍射测定。氢键链是通过C–H··π相互作用增强的C–H···O键形成的。相邻链通过π∙∙∙π相互作用连接。
更新日期:2020-01-14
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