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Structure of 2-chloro-N-(p-tol-yl)propanamide.
Jones, Roderick C; Twamley, Brendan.
Afiliação
  • Jones RC; Synthesis and Solid State Pharmaceutical Centre (SSPC), School of Chemical and, Bioprocess Engineering, University College Dublin, Belfield, Dublin 4, Ireland.
  • Twamley B; School of Chemistry, Trinity College Dublin, University of Dublin, College Green, Dublin 2, Ireland.
Acta Crystallogr E Crystallogr Commun ; 74(Pt 11): 1584-1588, 2018 Nov 01.
Article em En | MEDLINE | ID: mdl-30443386
Two independent samples of the title compound, alternatively 2-chloro-N-(4-methylphenyl)prop-an-amide, C10H12ClNO, 1, were studied using Cu Kα, 1a, and Mo Kα, 1b, radiation as part of a continuous crystallization study. The mol-ecule crystallizes with disorder in the Cl/terminal methyl positions [occupancies for the major disorder component of 0.783 (2) in 1a and and 0.768 (2) in 1b] and exhibits N-C bond lengths of 1.3448 (19), 1.344 (2) Å, C=O bond lengths of 1.2233 (18) and 1.2245 (19) Šand an acetamide moiety C-N-C-C torsion angle of 179.00 (13), 178.97 (14) ° for 1a and 1b, respectively. In the crystal, chains along the a axis are formed via N-H⋯O hydrogen bonds between acetamide groups, as well as C-H⋯O inter-actions. These chains arrange themselves into parallel running stacks which display weak C-Cl⋯O=C halogen bonding as well as weak C-H⋯π inter-actions.
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: Acta Crystallogr E Crystallogr Commun Ano de publicação: 2018 Tipo de documento: Article

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: Acta Crystallogr E Crystallogr Commun Ano de publicação: 2018 Tipo de documento: Article