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2-氨基-5-[(E)-(呋喃-2-基亚甲基)氨基]噻吩-3,4-二羧酸二乙酯

Diethyl 2-amino-5-[(E)-(furan-2-yl-methyl-idene)amino]-thio-phene-3,4-di-carboxyl-ate.

作者信息

Dufresne Stéphane, Skene W G

机构信息

Department of Chemistry, University of Montreal, CP 6128, succ. Centre-ville, Montréal, Québec, Canada H3C 3J7.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Oct 31;66(Pt 11):o3027. doi: 10.1107/S1600536810043746.

DOI:10.1107/S1600536810043746
PMID:21589183
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3009046/
Abstract

In the crystal structure of the title compound, C(15)H(16)N(2)O(5)S, the azomethine adopts the E configuration. The two heterocyclic rings adopt an anti-periplanar orientation. The mean planes of the thio-phene and furan rings are twisted by 2.51 (4)°. The crystal structure exhibits inter-molecular N-H⋯O hydrogen bonding. π-π stacking is also observed, the centroid-to-centroid distance being 3.770 (4) Å.

摘要

在标题化合物C(15)H(16)N(2)O(5)S的晶体结构中,亚甲胺采取E构型。两个杂环采取反式共平面取向。噻吩环和呋喃环的平均平面扭转了2.51 (4)°。晶体结构呈现分子间N-H⋯O氢键。还观察到π-π堆积,质心到质心距离为3.770 (4) Å。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d92b/3009046/64eced166c6c/e-66-o3027-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d92b/3009046/0ea0731e0cdf/e-66-o3027-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d92b/3009046/2de2d8aa5b67/e-66-o3027-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d92b/3009046/64eced166c6c/e-66-o3027-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d92b/3009046/0ea0731e0cdf/e-66-o3027-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d92b/3009046/2de2d8aa5b67/e-66-o3027-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d92b/3009046/64eced166c6c/e-66-o3027-fig3.jpg

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