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甲芬那酸两种酰肼衍生物的晶体结构,即3-(2,3-二甲基苯胺基)-1-[(Z)-(呋喃-2-基)亚甲基]苯甲酰肼和1-[(Z)-苄基亚甲基]-2-(2,3-二甲基苯胺基)苯甲酰肼。

Crystal structures of two hydrazide derivatives of mefenamic acid, 3-(2,3-di-methyl-anilino)-'-[()-(furan-2-yl)methyl-idene]benzohydrazide and '-[()-benzyl-idene]-2-(2,3-di-methyl-anilino)benzo-hydrazide.

作者信息

Mohamed Shaaban K, Mague Joel T, Akkurt Mehmet, Albayati Mustafa R, Elgarhy Sahar M I, Al-Taifi Elham A

机构信息

Chemistry and Environmental Division, Manchester Metropolitan University, Manchester, M1 5GD, England.

Chemistry Department, Faculty of Science, Minia University, 61519 El-Minia, Egypt.

出版信息

Acta Crystallogr E Crystallogr Commun. 2021 Feb 12;77(Pt 3):242-246. doi: 10.1107/S2056989021001353. eCollection 2021 Mar 1.

DOI:10.1107/S2056989021001353
PMID:33953944
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC8061108/
Abstract

The conformation about the central benzene ring in the mol-ecule of (I), CHNO, is partially determined by an intra-molecular N-H⋯O hydrogen bond. In the crystal, chains parallel to the axis are generated by inter-molecular N-H⋯O hydrogen bonds with the chains assembled into a three-dimensional network structure by inter-molecular C-H⋯O hydrogen bonds and C-H⋯π(ring) inter-actions. The mol-ecule of (II), CHNO, differs from (I) only in the substituent at the hydrazide N atom where a phenyl-methyl-ene moiety for (II) is present instead of a furan-methyl-ene moiety for (I). Hence, mol-ecules of (I) and (II) show similarities in their mol-ecular and crystal structures. The conformation of the central portion of the mol-ecule of (II) is also therefore partially determined by an intra-molecular N-H⋯O hydrogen bond and inter-molecular N-H⋯O hydrogen bonds form chains parallel to the axis. Likewise, the chains are connected into a three-dimensional network by C-H⋯O hydrogen bonds and C-H⋯π(ring) inter-actions.

摘要

(I)(CHNO)分子中中心苯环的构象部分由分子内N-H⋯O氢键决定。在晶体中,平行于 轴的链由分子间N-H⋯O氢键产生,这些链通过分子间C-H⋯O氢键和C-H⋯π(环)相互作用组装成三维网络结构。(II)(CHNO)分子与(I)的不同之处仅在于酰肼N原子上的取代基,(II)中存在苯基亚甲基部分,而(I)中为呋喃亚甲基部分。因此,(I)和(II)的分子在分子结构和晶体结构上表现出相似性。所以,(II)分子中心部分的构象也部分由分子内N-H⋯O氢键决定,分子间N-H⋯O氢键形成平行于 轴的链。同样,这些链通过C-H⋯O氢键和C-H⋯π(环)相互作用连接成三维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/03c279c138db/e-77-00242-fig6.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/b80e8a2d05a5/e-77-00242-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/b80068744e3a/e-77-00242-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/e2513bd34b43/e-77-00242-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/6c80e41a0e37/e-77-00242-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/4f92e2ff98de/e-77-00242-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/03c279c138db/e-77-00242-fig6.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/b80e8a2d05a5/e-77-00242-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/b80068744e3a/e-77-00242-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/e2513bd34b43/e-77-00242-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/6c80e41a0e37/e-77-00242-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/4f92e2ff98de/e-77-00242-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/21af/8061108/03c279c138db/e-77-00242-fig6.jpg

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