1-[4-(1H-咪唑-1-基)苯基]乙酮一水合物
1-[4-(1H-imidazol-1-yl)phen-yl]ethanone monohydrate.
作者信息
Ibrahim Halliru, Bala Muhammad D, Omondi Bernard
机构信息
School of Chemistry & Physics, University of KwaZulu-Natal, Westville Campus, Private Bag X54001, Durban 4000, South Africa.
出版信息
Acta Crystallogr Sect E Struct Rep Online. 2012 Jul 1;68(Pt 7):o2305. doi: 10.1107/S1600536812029157. Epub 2012 Jun 30.
In the crystal structure of the title compound, C(11)H(10)N(2)O·H(2)O, the solvent water mol-ecule links the organic mol-ecules through O-H⋯O and O-H⋯N hydrogen bonds, forming chains that run diagonally across the bc face. These chains are connected to adjacent chains through weak C-H⋯O inter-actions, resulting in hydrogen-bonded sheets extending along the b and c axes. The sheets are connected along the a axis through π-π inter-actions, with centroid-centroid distances of 3.7571 (9) and 3.7231 (9) Å.
在标题化合物C₁₁H₁₀N₂O·H₂O的晶体结构中，溶剂水分子通过O—H⋯O和O—H⋯N氢键连接有机分子，形成沿bc面斜向延伸的链。这些链通过弱C—H⋯O相互作用与相邻链相连，从而形成沿b轴和c轴延伸的氢键层。这些层沿a轴通过π-π相互作用相连，质心间距为3.7571 (9) Å和3.7231 (9) Å。
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