A comparative study of two polymorphs of L-aspartic acid hydrochloride

Acta Crystallogr C Struct Chem. 2014 Jul;70(Pt 7):689-92. doi: 10.1107/S2053229614013163. Epub 2014 Jun 14.

Abstract

Two polymorphs of L-aspartic acid hydrochloride, C4H8NO4(+)·Cl(-), were obtained from the same aqueous solution. Their crystal structures have been determined from single-crystal data collected at 100 K. The crystal structures revealed three- and two-dimensional hydrogen-bonding networks for the triclinic and orthorhombic polymorphs, respectively. The cations and anions are connected to one another via N-H···Cl and O-H···Cl interactions and form alternating cation-anion layer-like structures. The two polymorphs share common structural features; however, the conformations of the L-aspartate cations and the crystal packings are different. Furthermore, the molecular packing of the orthorhombic polymorph contains more interesting interactions which seems to be a favourable factor for more efficient charge transfer within the crystal.

Keywords: amino acids; crystal structure; hydrogen bonding; l-aspartic acid hydrochloride; pharmaceutical compounds; polymorphism.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Anions / chemistry*
  • Aspartic Acid / chemistry*
  • Cations / chemistry*
  • Crystallization
  • Hydrogen Bonding
  • Molecular Structure

Substances

  • Anions
  • Cations
  • Aspartic Acid