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2-(4-溴苯基)-N-(吡嗪-2-基)乙酰胺

2-(4-Bromo-phen-yl)-N-(pyrazin-2-yl)acetamide.

作者信息

Nayak Prakash S, Narayana B, Jasinski Jerry P, Yathirajan H S, Sarojini B K

机构信息

Department of Studies in Chemistry, Mangalore University, Mangalagangotri 574 199, India.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2013 May 15;69(Pt 6):o891. doi: 10.1107/S1600536813012531. Print 2013 Jun 1.

DOI:10.1107/S1600536813012531
PMID:23795067
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3685048/
Abstract

In the title compound, C12H10BrN3O, the dihedral angle between the mean planes of the 4-bromo-phenyl and pyrazin-2-yl rings is 54.6 (3)°. An intra-molecular C-H⋯O hydrogen bond generates an S(6) graph-set motif. In the crystal, weak N-H⋯N hydrogen bonds link the mol-ecules into chains along [100]. The chains are linked via C-H⋯N and C-H⋯O hydrogen bonds, forming two-dimensional networks lying parallel to the ab plane.

摘要

在标题化合物C₁₂H₁₀BrN₃O中,4-溴苯基和吡嗪-2-基环的平均平面之间的二面角为54.6 (3)°。分子内的C-H⋯O氢键形成一个S(6)图集 motif。在晶体中,弱的N-H⋯N氢键将分子沿[100]方向连接成链。这些链通过C-H⋯N和C-H⋯O氢键相连,形成平行于ab平面的二维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/357b/3685048/532cbdc61c3d/e-69-0o891-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/357b/3685048/1782460a72d6/e-69-0o891-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/357b/3685048/5d94f860bf0d/e-69-0o891-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/357b/3685048/532cbdc61c3d/e-69-0o891-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/357b/3685048/1782460a72d6/e-69-0o891-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/357b/3685048/5d94f860bf0d/e-69-0o891-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/357b/3685048/532cbdc61c3d/e-69-0o891-fig3.jpg

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