Cargando…

Crystal structure of 1-(4-formyl­benzyl­idene)thio­semicarbazone

The asymmetric unit of the title compound, C(9)H(9)N(3)OS, contains two approximately planar mol­ecules (r.m.s. deviations for 14 non-H atoms = 0.094 and 0.045 Å), with different conformations. In one of them, the C=O group is syn to the S atom and in the other it is anti. Each mol­ecule features an...

Descripción completa

Detalles Bibliográficos
Autores principales: Carballo, Rosa, Pino-Cuevas, Arantxa, Vázquez-López, Ezequiel M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186181/
https://www.ncbi.nlm.nih.gov/pubmed/25309285
http://dx.doi.org/10.1107/S1600536814017255
Descripción
Sumario:The asymmetric unit of the title compound, C(9)H(9)N(3)OS, contains two approximately planar mol­ecules (r.m.s. deviations for 14 non-H atoms = 0.094 and 0.045 Å), with different conformations. In one of them, the C=O group is syn to the S atom and in the other it is anti. Each mol­ecule features an intra­molecular N—H⋯N hydrogen bond, which generates an S(5) ring. In the crystal, mol­ecules are linked by N—H⋯O and N—H⋯S hydrogen bonds, generating discrete networks; the syn mol­ecules form [010] chains and the anti mol­ecules form (100) sheets.