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2-甲基-1-(4-甲基-苯基亚磺酰基)萘并-[2,1-b]呋喃

2-Methyl-1-(4-methyl-phenyl-sulfinyl)naphtho-[2,1-b]furan.

作者信息

Choi Hong Dae, Seo Pil Ja, Lee Uk

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Feb 1;68(Pt 2):o549. doi: 10.1107/S1600536812003121. Epub 2012 Jan 31.

DOI:10.1107/S1600536812003121
PMID:22347141
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3275285/
Abstract

In the title compound, C(20)H(16)O(2)S, the 4-methyl-phenyl ring makes a dihedral angle of 82.60 (4)° with the mean plane [r.m.s. deviation = 0.007 (1) Å] of the naphtho-furan fragment. In the crystal, mol-ecules are linked by weak inter-molecular C-H⋯O hydrogen bonds, and by a slipped π-π inter-action between the central naphtho-furan benzene rings of neighbouring mol-ecules [centroid-to-centroid distance = 3.671 (2) Å, inter-planar distance = 3.349 (2) Å and slippage = 1.503 (2)°].

摘要

在标题化合物C₂₀H₁₆O₂S中,4-甲基苯基环与萘并呋喃片段的平均平面[r.m.s.偏差 = 0.007 (1) Å]形成82.60 (4)°的二面角。在晶体中,分子通过弱分子间C-H⋯O氢键以及相邻分子的中心萘并呋喃苯环之间的滑移π-π相互作用相连[质心到质心距离 = 3.671 (2) Å,平面间距离 = 3.349 (2) Å,滑移 = 1.503 (2)°]。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7dca/3275285/72f325c174a3/e-68-0o549-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7dca/3275285/c3bac426d39d/e-68-0o549-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7dca/3275285/72f325c174a3/e-68-0o549-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7dca/3275285/c3bac426d39d/e-68-0o549-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7dca/3275285/72f325c174a3/e-68-0o549-fig2.jpg

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