首页> 美国卫生研究院文献>Acta Crystallographica Section E: Crystallographic Communications >N-(24-Difluoro­phen­yl)-5-methyl-12-oxazole-4-carboxamide hemihydrate
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N-(24-Difluoro­phen­yl)-5-methyl-12-oxazole-4-carboxamide hemihydrate

机译:N-(24-二氟­基)-5-甲基-12-恶唑-4-羧酰胺半水合物

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摘要

In the title compound, C11H8F2N2O2·0.5H2O, the dihedral angle between the benzene and isoxazole rings is 8.08 (3)°. In the crystal, the components are linked by O—H⋯N and N—H⋯O hydrogen bonds, in which the water mol­ecule acts as both a donor and an acceptor, into a tape with an R 4 4(16) graph-set motif along the a axis. The water mol­ecule is located on a twofold rotation axis. The methyl H atoms were treated as disordered groups over two sites with a refined site-occupancy ratio of 0.48 (6):0.52 (6).
机译:在标题化合物C11H8F2N2O2·0.5H2O中,苯与异恶唑环之间的二面角为8.08°(3)°。在晶体中,这些成分通过OHN和NHO氢键相连,其中水分子既充当供体又充当受体,并成带R 4 4 (16)沿a轴的图集主题。水分子位于双重旋转轴上。甲基H原子在两个位点上被视为无序基团,精确的位点占有率为0.48(6):0.52(6)。

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