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(2E)-3-(3-苄氧基苯基)-1-(2-羟基-5-甲基苯基)丙-2-烯-1-酮

(2E)-3-(3-Benzyl-oxyphen-yl)-1-(2-hydroxy-5-methyl-phen-yl)prop-2-en-1-one.

作者信息

Fun Hoong-Kun, Arshad Suhana, Sarojini B K, Khaleel V Musthafa, Narayana B

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Jun 1;67(Pt 6):o1372-3. doi: 10.1107/S1600536811016977. Epub 2011 May 11.

DOI:10.1107/S1600536811016977
PMID:21754763
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3120564/
Abstract

In the mol-ecule of the title compound, C(23)H(20)O(3), an intra-molecular O-H⋯O hydrogen bond generates an S(6) ring. The central benzene ring makes dihedral angles of 80.17 (8) and 16.99 (7)°, respectively, with the benz-yloxy and hy-droxy-methyl phenyl rings. In the crystal, mol-ecules are linked via inter-molecular C-H⋯O hydrogen bonds to form dimers. The dimers are connected by C-H⋯O hydrogen bonds and C-H⋯π inter-actions to form columns down the b axis.

摘要

在标题化合物C₂₃H₂₀O₃的分子中,分子内的O—H⋯O氢键形成一个S(6)环。中心苯环与苄氧基苯环和羟甲基苯环的二面角分别为80.17 (8)°和16.99 (7)°。在晶体中,分子通过分子间的C—H⋯O氢键相连形成二聚体。这些二聚体通过C—H⋯O氢键和C—H⋯π相互作用沿b轴形成柱状结构。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0eaf/3120564/a3b6178b7984/e-67-o1372-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0eaf/3120564/cc52e610e9c5/e-67-o1372-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0eaf/3120564/a3b6178b7984/e-67-o1372-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0eaf/3120564/cc52e610e9c5/e-67-o1372-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/0eaf/3120564/a3b6178b7984/e-67-o1372-fig2.jpg

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