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5-（1-环己烯-1-基）-3-（4-甲氧基苯基）异恶唑

5-(1-Cyclo-hexen-1-yl)-3-(4-methoxy-phen-yl)isoxazole.

作者信息

Vallejos Gabriel, Gutierrez Margarita, Astudillo Luis, Brito Iván, Cárdenas Alejandro

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Mar 28;65(Pt 4):o920. doi: 10.1107/S1600536809010903.

DOI:10.1107/S1600536809010903
PMID:21582622
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2968997/
Abstract

In the title compound, C(16)H(17)NO(2), the isoxazole ring makes a dihedral angle of 14.81 (13)° with the 4-methoxy-phenyl ring. Two atoms of the cyclo-hexene ring are disordered over two almost equally occupied positions [0.526 (13)/0.474 (13)]. The mol-ecular structure features a short intra-molecular C-H⋯O contact.

摘要

在标题化合物C(16)H(17)NO(2)中，异恶唑环与4-甲氧基苯基环形成的二面角为14.81 (13)°。环己烯环的两个原子在两个几乎等占据的位置上无序排列[0.526 (13)/0.474 (13)]。分子结构的特征是存在短的分子内C-H⋯O接触。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1c4c/2968997/f32c3cef3c24/e-65-0o920-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1c4c/2968997/bea1813a6fd6/e-65-0o920-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1c4c/2968997/f32c3cef3c24/e-65-0o920-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1c4c/2968997/bea1813a6fd6/e-65-0o920-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1c4c/2968997/f32c3cef3c24/e-65-0o920-fig2.jpg

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