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

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

Molecules of the title compound, C13H10ClN3O3, form centrosymmetric dimers via intermolecular N—H...N hydrogen bonds generating an R22(8) motif. The dimers are further connected through an O...Cl—C halogen bond [O...Cl = 3.233 (1) &#197...

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Bibliographic Details
Main Authors: Chun-Hsiang Lu, Chia-Jun Wu, Chun-Wei Yeh, Jhy-Der Chen
Format: Article
Language:English
Published: International Union of Crystallography 2011-08-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536811025268
Description
Summary:Molecules of the title compound, C13H10ClN3O3, form centrosymmetric dimers via intermolecular N—H...N hydrogen bonds generating an R22(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.
ISSN:1600-5368

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