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5-异丙亚基-1,3-二硫杂环戊烯并[4,5-d][1,3]二硫醇-2-硫酮

5-Isopropyl-idene-1,3-dithiolo[4,5-d][1,3]dithiole-2-thione.

作者信息

Tomura Masaaki, Yamashita Yoshiro

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Apr 18;65(Pt 5):o1050. doi: 10.1107/S160053680901335X.

DOI:10.1107/S160053680901335X
PMID:21583868
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2977732/
Abstract

The title compound, C(7)H(6)S(5), contains a 5-yl-idene-1,3-dithiolo[4,5-d][1,3]dithiole-2-thione framework, which is an important synthetic precursor of multi-dimensional organic superconductors and conductors. The mol-ecular framework is planar with an r.m.s. deviation of 0.012 Å for the non-H atoms. In the crystal structure, mol-ecules are linked by short inter-molecular S⋯S inter-actions [3.501 (5) and 3.581 (4) Å], constructing a zigzag mol-ecular tape network along the c axis.

摘要

标题化合物C(7)H(6)S(5)包含一个5-亚烷基-1,3-二硫杂环戊烯并[4,5-d][1,3]二硫代-2-硫酮骨架，它是多维有机超导体和导体的重要合成前体。分子骨架是平面的，非H原子的均方根偏差为0.012 Å。在晶体结构中，分子通过短的分子间S⋯S相互作用[3.501 (5)和3.581 (4) Å]相连，沿c轴构建了一个锯齿形分子带网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d7de/2977732/8ff21cdc3179/e-65-o1050-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d7de/2977732/e6293f2c8e8f/e-65-o1050-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d7de/2977732/8ff21cdc3179/e-65-o1050-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d7de/2977732/e6293f2c8e8f/e-65-o1050-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d7de/2977732/8ff21cdc3179/e-65-o1050-fig2.jpg

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