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(E)-2,2'-[3-(4-氟苯基)丙-2-烯-1,1-二基]双-(3-羟基-5,5-二甲基环己-2-烯-1-酮)

(E)-2,2'-[3-(4-Fluoro-phen-yl)prop-2-ene-1,1-di-yl]bis-(3-hy-droxy-5,5-dimethyl-cyclo-hex-2-en-1-one).

作者信息

Cha Joo Hwan, Min Sun-Joon, Cho Yong Seo, Lee Jae Kyun, Park Junghwan

机构信息

Advanced Analysis Center, Korea Institute of Science & Technology, Hwarangro 14-gil, Seongbuk-gu, Seoul 136-791, Republic of Korea.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2013 Mar 1;69(Pt 3):o397. doi: 10.1107/S1600536813004364. Epub 2013 Feb 20.

DOI:10.1107/S1600536813004364
PMID:23476580
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3588420/
Abstract

In the title compound, C25H29FO4, each cyclo-hexenone ring has an envelope conformation with the dimethyl-substituted atom as the flap. The hy-droxy and carbonyl groups form two intra-molecular O-H⋯O hydrogen bonds, as is typical for xanthene derivatives. In the crystal, very weak C-H⋯O hydrogen bonds link mol-ecules into dimers.

摘要

在标题化合物C25H29FO4中,每个环己烯酮环都具有信封式构象,以二甲基取代的原子作为瓣片。羟基和羰基形成两个分子内O-H⋯O氢键,这是呫吨衍生物的典型特征。在晶体中,非常弱的C-H⋯O氢键将分子连接成二聚体。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5378/3588420/44e80e6186e3/e-69-0o397-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5378/3588420/44e80e6186e3/e-69-0o397-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5378/3588420/44e80e6186e3/e-69-0o397-fig1.jpg

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