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2-((1E)-1-{2-[(2Z)-4-(4-Bromo-phen-yl)-3-phenyl-2,3-di-hydro-1,3-thia-zol-2-yl-idene]hydrazin-1-yl-idene}eth-yl)pyridin-1-ium bromide monohydrate.

ABSTRACT: In the title hydrated molecular salt, C22H18BrN4S(+)·Br(-)·H2O, the aromatic rings make dihedral angles of 14.20?(12), 34.29?(10) and 68.75?(11)° with the thia-zole ring. In the crystal, mol-ecules are linked into chains running parallel to the a axis by association of the bromide ions and the water mol-ecules of crystallization with the cations via N-H?O, O-H?Br, C-H?N and C-H?Br hydrogen-bonding inter-actions. C-H?? and C-Br?? [3.7426?(11)?Å, 161.73?(7)°] inter-actions are also observed, forming infinite chains extending along the b-axis direction.

SUBMITTER: Mague JT

PROVIDER: S-EPMC3998394 | biostudies-other | 2014 Mar

REPOSITORIES: biostudies-other

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2-((1E)-1-{2-[(2Z)-4-(4-Bromo-phen-yl)-3-phenyl-2,3-di-hydro-1,3-thia-zol-2-yl-idene]hydrazin-1-yl-idene}eth-yl)pyridin-1-ium bromide monohydrate.

Mague Joel T JT Mohamed Shaaban K SK Akkurt Mehmet M Abd El-Alaziz Ahmed T AT Albayati Mustafa R MR

Acta crystallographica. Section E, Structure reports online 20140222 Pt 3

In the title hydrated molecular salt, C22H18BrN4S(+)·Br(-)·H2O, the aromatic rings make dihedral angles of 14.20 (12), 34.29 (10) and 68.75 (11)° with the thia-zole ring. In the crystal, mol-ecules are linked into chains running parallel to the a axis by association of the bromide ions and the water mol-ecules of crystallization with the cations via N-H⋯O, O-H⋯Br, C-H⋯N and C-H⋯Br hydrogen-bonding inter-actions. C-H⋯π and C-Br⋯π [3.7426 (11) Å, 161.73 (7)°] inter-actions are also observed, formi ...[more]

PMID: 24765025

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