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4,6,7,9,10,12,13,15,16,18-Decahydro-1,3-dithiolo[4,5-l][1,4,7,10,15]trioxadithia-cyclo-hepta-decine-2-thione.

ABSTRACT: The title compound, C(13)H(20)O(3)S(5), is bis-ected by a crystallographic twofold rotation axis, which relates the two halves of the mol-ecule to one another: one S, one C and one O atom lie on the axis. The thione S atom lies in the plane of the five-membered rings with an r.m.s. deviation of 0.0042?(5)?Å. Parts of the 17-membered macrocycle were refined using a two-part disorder model [occupancies of 0.553?(14) and 0.447?(14)]. There are no noteworthy inter-molecular inter-actions.

SUBMITTER: Hou RB

PROVIDER: S-EPMC2979504 | biostudies-literature | 2010 May

REPOSITORIES: biostudies-literature

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4,6,7,9,10,12,13,15,16,18-Decahydro-1,3-dithiolo[4,5-l][1,4,7,10,15]trioxadithia-cyclo-hepta-decine-2-thione.

Hou Rui-Bin RB Li Bao B Yin Bing-Zhu BZ Wu Li-Xin LX

Acta crystallographica. Section E, Structure reports online 20100515 Pt 6

The title compound, C(13)H(20)O(3)S(5), is bis-ected by a crystallographic twofold rotation axis, which relates the two halves of the mol-ecule to one another: one S, one C and one O atom lie on the axis. The thione S atom lies in the plane of the five-membered rings with an r.m.s. deviation of 0.0042 (5) Å. Parts of the 17-membered macrocycle were refined using a two-part disorder model [occupancies of 0.553 (14) and 0.447 (14)]. There are no noteworthy inter-molecular inter-actions. ...[more]

PMID: 21579425

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