• Title of article

    Synthesis and structure of a 1:1 co-crystal of hexa­methyl­ene­tetra­mine carb­­oxy­borane and acetamino­phen

  • Author/Authors

    Ayudhya, Theppawut Department of Chemistry - University of Texas Permian Basin, USA , Raymond, Casey Department of Chemistry - State University of New York at Oswego - Oswego, New York, USA , Dingra, Nin Department of Chemistry - University of Texas Permian Basin, USA

  • Pages
    12
  • From page
    1
  • To page
    12
  • Abstract
    Hexa­methyl­ene­tetra­mine carboacetamino­phenborane, a mol­ecule with two pharmacophores attached to a central carb­oxy­borate moiety, was synthesized and crystals were grown with an acetamino­phen co-crystal former to result in the title 1:1 co-crystal [hexa­methyl­ene­tetra­mine 4-acetamido­phenyl 2-boranyl­acetate–4-acet­amido­phenol (1/1)], C15H22BN5O3·C8H9NO2. In the first of these mol­ecules, both the borate-ester and acetyl­amino groups are considerably twisted away from the plane of the inter­vening benzene ring [dihedral angles = 76.89 (9) and 65.42 (9)°, respectively]. The extended structure of this co-crystal features N—H⋯O and O—H⋯O hydrogen bonds, which link the components into (100) sheets and weak C—H⋯O hydrogen bonds help to consolidate the structure.
  • Keywords
    co-crystal structure , CORCB , amine carb­oxy­borane , acetamino­phen
  • Journal title
    Acta Crystallographica Section E: Crystallographic Communications
  • Serial Year
    2020
  • Record number

    2622520