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Crystal structure of 4-hy-droxy-3-meth-oxy-benzaldehyde 4-methyl-thio-semi-carbazone methanol monosolvate.


ABSTRACT: In the title solvate, C15H15N3O2S·CH3OH, the thio-semicarbazone mol-ecule is approximately planar; the maximum deviation from the mean plane is 0.4659?(14)?Å and the dihedral angle between the aromatic rings is 9.83?(8)°. This conformation is supported by an intra-molecular N-H?N hydrogen bond. In the crystal, the thio-semicarbazone mol-ecules are linked into dimers by pairs of N-H?S hydrogen bonds, thereby generating R 2 (2)(8) loops. The methanol solvent mol-ecule bonds to the thio-semicarbazone mol-ecule through a bifurcated O-H?(O,O) hydrogen bond and also accepts an O-H?O link from the thio-semicarbazone mol-ecule. Together, these links generate a three-dimensional network.

SUBMITTER: de Oliveira AB 

PROVIDER: S-EPMC4420048 | biostudies-literature | 2015 May

REPOSITORIES: biostudies-literature

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Crystal structure of 4-hy-droxy-3-meth-oxy-benzaldehyde 4-methyl-thio-semi-carbazone methanol monosolvate.

de Oliveira Adriano Bof AB   Beck Johannes J   Landvogt Christian C   Feitosa Bárbara Regina Santos BR  

Acta crystallographica. Section E, Crystallographic communications 20150418 Pt 5


In the title solvate, C15H15N3O2S·CH3OH, the thio-semicarbazone mol-ecule is approximately planar; the maximum deviation from the mean plane is 0.4659 (14) Å and the dihedral angle between the aromatic rings is 9.83 (8)°. This conformation is supported by an intra-molecular N-H⋯N hydrogen bond. In the crystal, the thio-semicarbazone mol-ecules are linked into dimers by pairs of N-H⋯S hydrogen bonds, thereby generating R 2 (2)(8) loops. The methanol solvent mol-ecule bonds to the thio-semicarbazo  ...[more]

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