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(2E)-1-(2,5-二氯-3-噻吩基)-3-(6-甲氧基-2-萘基)-2-丙烯-1-酮

(2E)-1-(2,5-Dichloro-3-thien-yl)-3-(6-meth-oxy-2-naphth-yl)prop-2-en-1-one.

作者信息

Jasinski Jerry P, Pek Albert E, Chidan Kumar C S, Yathirajan H S, Mayekar A N

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 18;66(Pt 7):o1717. doi: 10.1107/S1600536810022725.

DOI:10.1107/S1600536810022725
PMID:21587934
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3006779/
Abstract

In the title compound, C(18)H(12)Cl(2)O(2)S, the dihedral angle between the thio-phene ring and the naphthalene ring system is 2.13 (4)°. In the crystal, pairs of weak inter-molecular C-H⋯O hydrogen bonds form centrosymmetric dimers.

摘要

在标题化合物C₁₈H₁₂Cl₂O₂S中,噻吩环与萘环体系之间的二面角为2.13 (4)°。在晶体中,成对的弱分子间C-H⋯O氢键形成中心对称二聚体。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/98b4/3006779/3134be73c47f/e-66-o1717-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/98b4/3006779/e071be49d8b0/e-66-o1717-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/98b4/3006779/745f68bbac94/e-66-o1717-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/98b4/3006779/3134be73c47f/e-66-o1717-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/98b4/3006779/e071be49d8b0/e-66-o1717-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/98b4/3006779/745f68bbac94/e-66-o1717-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/98b4/3006779/3134be73c47f/e-66-o1717-fig3.jpg

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Structure validation in chemical crystallography.化学晶体学中的结构验证
Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55. doi: 10.1107/S090744490804362X. Epub 2009 Jan 20.
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A short history of SHELX.SHELX简史。
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Acta Crystallogr E Crystallogr Commun. 2018 Jul 24;74(Pt 8):1134-1137. doi: 10.1107/S2056989018010216. eCollection 2018 Aug 1.
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1-(2,5-Dichloro-3-thien-yl)ethanone: infinite sheets mediated by O⋯Cl halogen bonds.1-(2,5-二氯-3-噻吩基)乙酮:由O⋯Cl卤键介导的无限层结构。
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