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Updated: Jun 1, 2026
11:45
Preparation of Stable Bicyclic Aziridinium Ions and Their Ring-Opening for the Synthesis of Azaheterocycles
Published on: August 22, 2018
1-Chloro-acetyl-r-2,c-6-bis-(4-methoxy-phen-yl)-c-3,t-3-dimethyl-piperidin-4-one.
Summary
This study details the molecular structure of a specific chlorinated organic compound. Researchers observed unique spatial arrangements and intermolecular interactions within its crystal form.
Area of Science:
- Organic Chemistry
- Crystallography
- Molecular Structure Analysis
Background:
- Understanding the three-dimensional structure of organic molecules is crucial for predicting their chemical behavior and potential applications.
- Piperidine derivatives are common scaffolds in medicinal chemistry and materials science, necessitating detailed structural characterization.
Purpose of the Study:
- To elucidate the precise molecular conformation and crystal packing of the title compound, C(23)H(26)ClNO(4).
- To identify and analyze intramolecular and intermolecular interactions influencing the compound's solid-state structure.
Main Methods:
- Single-crystal X-ray diffraction was employed to determine the atomic arrangement.
- Conformational analysis of the piperidine ring and identification of hydrogen bonding and other non-covalent interactions were performed.
Main Results:
- The piperidine ring was found to adopt a distorted boat conformation.
- Methoxy-phenyl substituents were observed in axial and equatorial positions, influencing the ring's geometry.
- An intramolecular hydrogen bond (C-H⋯Cl) and intermolecular interactions (C-H⋯π) forming zigzag chains were identified.
Conclusions:
- The specific conformation and intermolecular interactions dictate the crystal structure of this chlorinated organic compound.
- Detailed structural insights provide a foundation for further studies on structure-activity relationships or material properties.
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