• Title of article

    Crystal structure of a new polymorph of 3-acetyl-8-meth­­oxy-2H-chromen-2-one

  • Author/Authors

    Gonzalez-Carrillo, Gabino Facultad de Ciencias Químicas - Universidad de Colima, Mexico , Muñiz-Valencia, Roberto Facultad de Ciencias Químicas - Universidad de Colima, Mexico , García-Báez, Efren V. Laboratorio de Quimica Supramolecular y Nanociencias - Unidad Profesional, Interdisciplinaria de Biotecnología - Instituto Politécnico Nacional - Avenida Acueducto s/n, Mexico , Martínez-Martínez, Francisco J. Facultad de Ciencias Químicas - Universidad de Colima, Mexico

  • Pages
    9
  • From page
    1
  • To page
    9
  • Abstract
    A new polymorphic form of the title compound, C12H10O4, is described in the ortho­rhom­bic space group Pbca and Z = 8, as compared to polymorph I, which crystallizes in the monoclinic space group C2/c and Z = 8 [Li et al. (2012). Chin. J. Struct. Chem. 31, 1003–1007.]. In polymorph II, the coumarin ring system is almost planar (r.m.s. deviation = 0.00129 Å). In the crystal, mol­ecules are connected by Csp3—H⋯O and Car—H⋯O hydrogen bonds, forming mol­ecular sheets linked into zigzag shaped layers along the b-axis direction. The three-dimensional lattice is assembled through stacking of the zigzag layers by π–π inter­actions with a centroid-to-centroid distance of 3.600 (9) Å and anti­parallel C=O⋯C=O inter­actions with a distance of 3.1986 (17) Å, which give rise to a helical supra­molecular architecture.
  • Keywords
    crystal structure , polymorph , hydrogen bond , coumarin , 3-acetyl-8-meth­oxy-coumarin
  • Journal title
    Acta Crystallographica Section E: Crystallographic Communications
  • Serial Year
    2019
  • Record number

    2624594