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外消旋2-[(β-阿拉伯吡喃糖基)-硫烷基]-4,6-二苯基吡啶-3-甲腈的晶体结构

Crystal structure of racemic 2-[(β-arabino-pyran-osyl)-sulfanyl]-4,6-diphenylpyridine-3-carbo-nitrile.

作者信息

Hammad Sherif F, Masoud Doaa M, Elgemeie Galal H, Jones Peter G

机构信息

Pharmaceutical Chemistry Department, Faculty of Pharmacy, Helwan University, Cairo, Egypt.

Chemistry Department, Faculty of Science, Helwan University, Cairo, Egypt.

出版信息

Acta Crystallogr E Crystallogr Commun. 2018 May 25;74(Pt 6):853-856. doi: 10.1107/S2056989018007284. eCollection 2018 Jun 1.

Abstract

In the racemic title compound, CHNOS, the sulfur atom is attached equatorially to the sugar ring with unequal S-C bonds, .: S-C = 1.808 (2) and S-C = 1.770 (2) Å (s = sugar, p = pyrid-yl). The dihedral angles between the pyridine ring and its attached phenyl groups are 42.24 (8) and 6.37 (14)°. In the crystal, a system of classical O-H⋯O and O-H⋯(O,O) hydrogen bonds links the mol-ecules to form tube-like assemblies propagating parallel to the -axis direction. Weak C-H⋯N inter-actions are also observed.

摘要

在消旋标题化合物CHNOS中,硫原子以不等长的S-C键(S-C = 1.808 (2) Å和S-C = 1.770 (2) Å,s = 糖基,p = 吡啶基)赤道面连接到糖环上。吡啶环与其相连的苯基之间的二面角分别为42.24 (8)°和6.37 (14)°。在晶体中,经典的O-H⋯O和O-H⋯(O,O)氢键体系将分子连接起来,形成平行于c轴方向传播的管状聚集体。还观察到弱的C-H⋯N相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/cbc7/6002821/7cdcf7eefb0d/e-74-00853-fig1.jpg

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