Related Experiment Video
Updated: Jun 1, 2026
11:04
Preparation of Enantiopure Non-Activated Aziridines and Synthesis of Biemamide B, D, and epiallo-Isomuscarine
Published on: June 13, 2022
Imidazolium 4-amino-benzoate.
Summary
This study characterizes a novel salt, detailing the carboxylate group
Area of Science:
- Crystallography
- Materials Science
- Chemical Physics
Background:
- Understanding the crystal structure of organic salts is crucial for predicting their physical and chemical properties.
- 4-aminobenzoate derivatives are important in various chemical applications.
- Investigating intermolecular interactions provides insights into material stability and assembly.
Purpose of the Study:
- To elucidate the crystal structure and intermolecular interactions of a specific organic salt.
- To analyze the spatial arrangement of the 4-aminobenzoate anion and its cation.
- To characterize the hydrogen bonding and C-H···O contacts within the crystal lattice.
Main Methods:
- Single-crystal X-ray diffraction was employed to determine the molecular and crystal structure.
- Analysis of bond lengths, bond angles, and dihedral angles.
- Identification and characterization of hydrogen bonding and other non-covalent interactions.
Main Results:
- The crystal structure of the title salt (C(3)H(5)N(2) (+)·C(7)H(6)NO(2) (-)) was determined.
- A dihedral angle of 13.23(17)° was observed between the carboxylate group and the benzene ring of the 4-aminobenzoate anion.
- Extended three-dimensional networks were formed via N-H···O hydrogen bonds and C-H···O contacts.
Conclusions:
- The study provides a detailed structural analysis of the organic salt.
- The identified intermolecular interactions dictate the formation of a 3D supramolecular architecture.
- This structural information is vital for the design of new materials with tailored properties.
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