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6-(4-Chloro-phen-yl)-3-methyl-imidazo[2,1-b]thia-zole.

ABSTRACT: In the title compound, C12H9ClN2S, the imidazo[2,1-b]thia-zole fragment is planar (r.m.s. deviation = 0.003?Å), and the benzene ring is twisted slightly [by 5.65?(6)°] relative to this moiety. In the crystal, mol-ecules are linked by ?-? stacking inter-actions into columns along [010]. The mol-ecules within the columns are arranged alternatively by their planar rotation of 180°. Thus, in the columns, there are the two types of ?-? stacking inter-actions, namely, (i) between two imidazo[2,1-b]thia-zole fragments [inter-planar distance = 3.351?(2)?Å] and (ii) between an imidazo[2,1-b]thia-zole fragment and the phenyl ring [inter-planar distance = 3.410?(5)?Å]. There are no short contacts between the columns.

SUBMITTER: Bunev AS

PROVIDER: S-EPMC3884351 | biostudies-literature | 2013 Oct

REPOSITORIES: biostudies-literature

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6-(4-Chloro-phen-yl)-3-methyl-imidazo[2,1-b]thia-zole.

Bunev Alexander S AS Sukhonosova Elena V EV Statsyuk Vladimir E VE Ostapenko Gennady I GI Khrustalev Victor N VN

Acta crystallographica. Section E, Structure reports online 20131026 Pt 11

In the title compound, C12H9ClN2S, the imidazo[2,1-b]thia-zole fragment is planar (r.m.s. deviation = 0.003 Å), and the benzene ring is twisted slightly [by 5.65 (6)°] relative to this moiety. In the crystal, mol-ecules are linked by π-π stacking inter-actions into columns along [010]. The mol-ecules within the columns are arranged alternatively by their planar rotation of 180°. Thus, in the columns, there are the two types of π-π stacking inter-actions, namely, (i) between two imidazo[2,1-b]thi ...[more]

PMID: 24454127

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