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1-Benzoyl-4-thio-biuret.

ABSTRACT: IN THE TITLE COMPOUND (SYSTEMATIC NAME: {[(phenyl-formamido)-carbon-yl]amino}-methane-thio-amide), C9H9N3O2S, both benzoyl and terminal thio-urea fragments adopt transoid conformations with respect to the central carbonyl O atom. The benzoyl and thio-biuret groups are almost coplanar, making a dihedral angle of 4.40?(8)°. The mol-ecular structure is stabilized by two intra-molecular N-H?O hydrogen bonds. In the crystal, N-H?O and N-H?S hydrogen bonds link the mol-ecules into a tape running along [101].

SUBMITTER: Kang SK

PROVIDER: S-EPMC3793812 | biostudies-other | 2013

REPOSITORIES: biostudies-other

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1-Benzoyl-4-thio-biuret.

Kang Sung Kwon SK

Acta crystallographica. Section E, Structure reports online 20130727 Pt 8

<h4>In the title compound (systematic name</h4>{[(phenyl-formamido)-carbon-yl]amino}-methane-thio-amide), C9H9N3O2S, both benzoyl and terminal thio-urea fragments adopt transoid conformations with respect to the central carbonyl O atom. The benzoyl and thio-biuret groups are almost coplanar, making a dihedral angle of 4.40 (8)°. The mol-ecular structure is stabilized by two intra-molecular N-H⋯O hydrogen bonds. In the crystal, N-H⋯O and N-H⋯S hydrogen bonds link the mol-ecules into a tape runnin ...[more]

PMID: 24109399

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