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4,5-二茂铁基-1,2-二硫醇-3-硫酮

4,5-Diferrocenyl-1,2-di-thiole-3-thione.

作者信息

Sánchez-García Jessica J, Flores-Alamo Marcos, Nuñez-Gordillo Amairany, Klimova Elena I

机构信息

Facultad de Química, Universidad Nacional Autónoma de México, Ciudad Universitaria, Ciudad de México, 04510, Mexico.

出版信息

IUCrdata. 2022 Oct 25;7(Pt 10):x221011. doi: 10.1107/S2414314622010112. eCollection 2022 Oct.

DOI:10.1107/S2414314622010112
PMID:36405852
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC9638058/
Abstract

The structure of 4,5-diferrocenyl-1,2-di-thiole-3-thione, [Fe(CH)(CHS)] or CHFeS, at 130 K has monoclinic (2/) symmetry. The molecule has two ferrocenyl units attached to a 1,2-di-thiole-3-thione moiety. It is of inter-est with respect to the question if the introduction of ferrocenyl substituents into biologically active mol-ecules offers the potential to obtain more efficacious therapeutic drugs. The crystal structure displays inter-molecular contacts of the C-H⋯S and S-π(C-C) types.

摘要

4,5-二茂铁基-1,2-二硫醇-3-硫酮,即[Fe(CH)(CHS)]或CHFeS,在130 K时具有单斜晶系(2/)对称性。该分子有两个二茂铁基单元连接到一个1,2-二硫醇-3-硫酮部分。就将二茂铁基取代基引入生物活性分子是否有可能获得更有效的治疗药物这一问题而言,它很有趣。晶体结构显示出C-H⋯S和S-π(C-C)类型的分子间接触。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6813/9638058/71dda4837e11/x-07-x221011-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6813/9638058/22f114478f7c/x-07-x221011-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6813/9638058/71dda4837e11/x-07-x221011-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6813/9638058/22f114478f7c/x-07-x221011-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/6813/9638058/71dda4837e11/x-07-x221011-fig2.jpg

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