Methyl 4-[(5-chloro­pyrimidin-2-yl)carbamo­yl]benzoate

Mol­ecules of the title compound, C(13)H(10)ClN(3)O(3), form centrosymmetric dimers via inter­molecular N—H⋯N hydrogen bonds generating an R (2) (2)(8) motif. The dimers are further connected through an O⋯Cl—C halogen bond [O⋯Cl = 3.233 (1) Å and O⋯Cl—C = 167.33 (1)°] into a chain along [110]. The s...

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Detalles Bibliográficos
Autores principales: Lu, Chun-Hsiang, Wu, Chia-Jun, Yeh, Chun-Wei, Chen, Jhy-Der
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3212268/
https://www.ncbi.nlm.nih.gov/pubmed/22090925
http://dx.doi.org/10.1107/S1600536811025268
Descripción
Sumario:Mol­ecules of the title compound, C(13)H(10)ClN(3)O(3), form centrosymmetric dimers via inter­molecular N—H⋯N hydrogen bonds generating an R (2) (2)(8) motif. The dimers are further connected through an O⋯Cl—C halogen bond [O⋯Cl = 3.233 (1) Å and O⋯Cl—C = 167.33 (1)°] into a chain along [110]. The secondary amide group adopts a cis conformation. Weak C—H⋯N hydrogen bonds among the methyl benzoate and pyrimidyl rings are also observed in the crystal structure.

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