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Crystal structure of 4-amino-1-benzyl-1,2,4-triazolin-5-one

The title compound, C(9)H(10)N(4)O, was obtained unintentionally by hydrolysis of 4-amino-1-benzyl-5-methyl­sulfanyl-1,2,4-triazolium tetra­fluoro­borate in the presence of sodium azide. In the crystal, alternating layers of polar amino­triazolinone and apolar benzene moieties are observed. N—H⋯O hy...

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Detalles Bibliográficos
Autores principales: Laus, Gerhard, Kahlenberg, Volker, Schottenberger, Herwig
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257189/
https://www.ncbi.nlm.nih.gov/pubmed/25484684
http://dx.doi.org/10.1107/S160053681401931X
Descripción
Sumario:The title compound, C(9)H(10)N(4)O, was obtained unintentionally by hydrolysis of 4-amino-1-benzyl-5-methyl­sulfanyl-1,2,4-triazolium tetra­fluoro­borate in the presence of sodium azide. In the crystal, alternating layers of polar amino­triazolinone and apolar benzene moieties are observed. N—H⋯O hydrogen bonds between the amino and carbonyl groups form infinite chains along [010]. These infinite chains are linked by additional C—H⋯O contacts.