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2-(1,3-Benzothia-zol-2-yl)guanidin-2-ium acetate.

ABSTRACT: In the title compound, C(8)H(9)N(4)S(-)·C(2)H(3)O(2) (-), the cation is essentially planar (r.m.s deviation = 0.037?Å) with the guanidine unit bent out of the plane of the fused-ring system by 4.6?(3)°. In the asymmetric unit, the cations and anions are linked into R(2) (2)(8) motifs. In the crystal, further N-H?O and N-H?N hydrogen bonds link the components into a two-dimensional network.

SUBMITTER: Horton PN

PROVIDER: S-EPMC3247334 | biostudies-literature | 2011 Nov

REPOSITORIES: biostudies-literature

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2-(1,3-Benzothia-zol-2-yl)guanidin-2-ium acetate.

Horton Peter N PN Coles Simon J SJ Mohamed Shaaban K SK El-Remaily Mahmoud A A MA Soliman A M AM

Acta crystallographica. Section E, Structure reports online 20111012 Pt 11

In the title compound, C(8)H(9)N(4)S(-)·C(2)H(3)O(2) (-), the cation is essentially planar (r.m.s deviation = 0.037 Å) with the guanidine unit bent out of the plane of the fused-ring system by 4.6 (3)°. In the asymmetric unit, the cations and anions are linked into R(2) (2)(8) motifs. In the crystal, further N-H⋯O and N-H⋯N hydrogen bonds link the components into a two-dimensional network. ...[more]

PMID: 22219952

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