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(E,E)-3,3'-二甲基-1,1'-二苯基-4,4'-{(乙烷-1,2-二亚氨基)-双-[(2-呋喃基)亚甲基]}二-1H-吡唑-5(4H)-酮

(E,E)-3,3'-Dimethyl-1,1'-diphenyl-4,4'-{(ethane-1,2-diyldiimino)-bis-[(2-fur-yl)methyl-idyne]}di-1H-pyrazol-5(4H)-one.

作者信息

Wang Hai-Wen

机构信息

East China University of Science and Technology, Collage of Chemistry and Molecular Engineering, Mei Long Road 130, Shanghai 200237, People's Republic of China.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 5;66(Pt 7):o1534. doi: 10.1107/S160053681001980X.

DOI:10.1107/S160053681001980X
PMID:21587783
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3006829/
Abstract

The complete molecule of the title compound of the title compound, C(32)H(28)N(6)O(4), is generated by crystallographic inversion symmetry. The dihedral angles between the pyrazalone ring and the pendant phenyl and furan rings are 15.65 (8) and 65.06 (8)°, respectively. In the crystal, the molecules are linked by N-H⋯O, C-H⋯O and weak C-H⋯π interactions.

摘要

标题化合物C(32)H(28)N(6)O(4)的完整分子通过晶体学倒转对称性产生。吡唑啉酮环与悬垂苯基和呋喃环之间的二面角分别为15.65 (8)°和65.06 (8)°。在晶体中,分子通过N-H⋯O、C-H⋯O和弱C-H⋯π相互作用相连。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1363/3006829/a6cef7ce1d4f/e-66-o1534-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1363/3006829/a6cef7ce1d4f/e-66-o1534-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1363/3006829/a6cef7ce1d4f/e-66-o1534-fig1.jpg

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本文引用的文献

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A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.
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