Related Experiment Video
Updated: Sep 11, 2025

Construction and Systematical Symmetric Studies of a Series of Supramolecular Clusters with Binary or Ternary Ammonium Triphenylacetates
Published on: February 15, 2016
First Crystal Structure of an Aspartame Cocrystal.
Nazanin Fereidouni1, Marwah Aljohani2, Andrea Erxleben1,3
1School of Biological and Chemical Sciences, University of Galway, Galway H91TK33, Ireland.
This study reports the first crystal structure of an aspartame cocrystal, revealing insights into its challenging needle-like crystallization. Understanding this behavior is key for industrial processing and fundamental solid-state research.
Area of Science:
- Crystallography
- Materials Science
- Pharmaceutical Science
Background:
- Aspartame exhibits extreme needle-like crystallization, posing industrial processing challenges.
- Cocrystallization offers a method to modify solid-state properties and improve compound handling.
- No prior crystal structures of aspartame cocrystals were available.
Purpose of the Study:
- To investigate the cocrystallization of aspartame with various coformers.
- To determine the crystal structure of any identified aspartame cocrystals.
- To understand the structural basis for aspartame's crystallization behavior.
Main Methods:
- Comprehensive cocrystal screening of aspartame.
- Powder X-ray diffraction (PXRD) analysis for cocrystal identification.
- Single-crystal X-ray diffraction for structural determination.
Main Results:
- Cocrystals of aspartame with fumaric acid and 4-hydroxybenzoic acid were identified via PXRD.
- Despite crystallization challenges, single crystals of aspartame·4-hydroxybenzoic acid dihydrate were obtained.
- The first crystal structure of an aspartame cocrystal was determined.
Conclusions:
- The structure of aspartame·4-hydroxybenzoic acid dihydrate reveals specific hydrogen bonding patterns.
- These interactions, particularly the spiral formation of aspartame zwitterions, explain the needle growth and cocrystal isolation difficulties.
- This work provides fundamental insights into aspartame's solid-state behavior and cocrystal formation.
Related Concept Videos
Ionic Crystal Structures
Most monatomic ions behave as charged spheres, and their attraction for ions of opposite charge is the same in every direction. Consequently, stable structures for ionic compounds result (1) when ions of one charge are surrounded by as many ions as possible of the opposite...
Crystal Field Theory - Octahedral Complexes
To explain the observed behavior of transition metal complexes (such as colors), a model involving electrostatic interactions between the electrons from the ligands and the electrons in the unhybridized d orbitals of the central metal atom has been developed. This electrostatic model is crystal field theory (CFT). It helps to understand, interpret, and predict the colors, magnetic behavior, and some structures of coordination compounds of transition metals.
CFT focuses on...
Recrystallization: Solid–Solution Equilibria
Metallic Solids
All metallic solids exhibit high thermal and electrical conductivity, metallic luster, and malleability....
Structure of Amines
Crystal Field Theory - Tetrahedral and Square Planar Complexes
Crystal field theory (CFT) is applicable to molecules in geometries other than octahedral. In octahedral complexes, the lobes of the dx2−y2 and dz2 orbitals point directly at the ligands. For tetrahedral complexes, the d orbitals remain in place, but with only four ligands located between the axes. None of the orbitals points directly at the tetrahedral ligands. However, the dx2−y2 and dz2 orbitals (along the Cartesian axes) overlap with the ligands less than the dxy,...

