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4-Bromo-2H-1,3-oxazine-2,6(3H)-dione

The title compound, C(4)H(2)BrNO(3), is one of a series of three substituted oxauracils prepared as precursors in the preparation of 1-aza-1,3-butadienes. Although each structure has identical potential for N—H⋯O inter­molecular hydrogen bonds, each forms a distinctive inter­molecular network. In th...

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Detalles Bibliográficos
Autores principales: Parrish, Damon, Tivitmahaisoon, Parcharee, Rehberg, Gretchen M., Kastner, Margaret E.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970500/
https://www.ncbi.nlm.nih.gov/pubmed/21577824
http://dx.doi.org/10.1107/S1600536809034631
Descripción
Sumario:The title compound, C(4)H(2)BrNO(3), is one of a series of three substituted oxauracils prepared as precursors in the preparation of 1-aza-1,3-butadienes. Although each structure has identical potential for N—H⋯O inter­molecular hydrogen bonds, each forms a distinctive inter­molecular network. In the title compound, there are two independent mol­ecules in the asymmetric unit, with a non-crystallographic twofold screw-like relationship between them. The two indpendent mol­ecules are linked by an inter­molecular N—H⋯O hydrogen bond. In the crystal structure, this hydrogen-bonded pair is linked to translationally related mol­ecules through further inter­molecular N—H⋯O hydrogen bonds, forming one-dimensional chains along [100]. The crystal structure also has short Br⋯O=C inter­molecular contacts with distances of 2.843 (4) and 2.852 (4) Å.