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消旋9,10 - 二甲氧基 - 3 - 甲基 - 6 - 苯基 - 7,7a - 二氢 - 苯并[b]苯并[4,5]异噻唑并[2,3 - d][1,4]二氮杂卓12,12 - 二氧化物

Racemic 9,10-dimeth-oxy-3-methyl-6-phenyl-7,7a-dihydro-benzo[b]benzo[4,5]isothia-zolo[2,3-d][1,4]diazepine 12,12-dioxide.

作者信息

Bassin Jatinder P, Shah Virender P, Martin Lee, Horton Peter N

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Feb 23;67(Pt 3):o684-5. doi: 10.1107/S1600536811004983.

DOI:10.1107/S1600536811004983
PMID:21522430
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3052004/
Abstract

There are two molecules in the asymmetric unit of the title compound, C(24)H(22)N(2)O(4)S. The conformation of the seven-membered ring is twisted boat for both molecules. The molecule is chiral, but crystal symmetry generates a recemate. The crystal packing is stabilized by weak intermolecular C-H⋯O hydrogen bonds.

摘要

标题化合物C₂₄H₂₂N₂O₄S的不对称单元中有两个分子。两个分子中七元环的构象均为扭船式。该分子是手性的，但晶体对称性产生了外消旋体。晶体堆积通过弱分子间C—H⋯O氢键得以稳定。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8cc8/3052004/7c865b8f4cf0/e-67-0o684-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8cc8/3052004/7c865b8f4cf0/e-67-0o684-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8cc8/3052004/7c865b8f4cf0/e-67-0o684-fig1.jpg

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