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5-Bromo-2-hy-droxy-benzaldehyde thio-semicarbazone.

ABSTRACT: The mol-ecule of the title compound, C(8)H(8)BrN(3)OS, is close to being planar, with maximum deviations of -0.127?(3) and 0.135?(5)?Å for the N atoms of the -NH- and NH(2)- groups, respectively. Intra-molecular N-H?N and O-H?N hydrogen bonds to the same acceptor N atom generate S(5) and S(6) ring motifs. In the crystal structure, mol-ecules are connected into [010] chains by pairs of N-H?S hydrogen bonds with R(2) (2)(8) graph-set motifs. The crystal used for data collection was found to be an inversion twin.

SUBMITTER: Kargar H

PROVIDER: S-EPMC3009273 | biostudies-literature | 2010 Oct

REPOSITORIES: biostudies-literature

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5-Bromo-2-hy-droxy-benzaldehyde thio-semicarbazone.

Kargar Hadi H Kia Reza R Akkurt Mehmet M Büyükgüngör Orhan O

Acta crystallographica. Section E, Structure reports online 20101031 Pt 11

The mol-ecule of the title compound, C(8)H(8)BrN(3)OS, is close to being planar, with maximum deviations of -0.127 (3) and 0.135 (5) Å for the N atoms of the -NH- and NH(2)- groups, respectively. Intra-molecular N-H⋯N and O-H⋯N hydrogen bonds to the same acceptor N atom generate S(5) and S(6) ring motifs. In the crystal structure, mol-ecules are connected into [010] chains by pairs of N-H⋯S hydrogen bonds with R(2) (2)(8) graph-set motifs. The crystal used for data collection was found to be an ...[more]

PMID: 21589160

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