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2,4,6-Trimethyl-1,3,5-tris-(morpholino-meth-yl)benzene
Acta Crystallographica. Section E, Structure Reports Online
|January 5, 2011
Summary
This study details the crystal structure of a novel organic compound, C(24)H(39)N(3)O(3). The research reveals disordered methyl groups and asymmetric morpholino arrangements, forming a unique one-dimensional chain via intermolecular interactions.
Area of Science:
- Crystallography
- Organic Chemistry
- Supramolecular Chemistry
Background:
- Understanding molecular arrangements is crucial for designing new materials.
- Morpholino groups and mesitylene scaffolds are common in organic synthesis.
- Intermolecular interactions dictate solid-state structures.
Purpose of the Study:
- To elucidate the crystal structure of the title compound C(24)H(39)N(3)O(3).
- To analyze the conformational preferences of morpholino groups.
- To investigate the intermolecular forces driving self-assembly.
Main Methods:
- Single-crystal X-ray diffraction analysis.
- Analysis of atomic disorder and site-occupation factors.
- Identification and characterization of intermolecular interactions (C-H⋯π).
Main Results:
- The crystal structure of C(24)H(39)N(3)O(3) was determined.
- Methyl groups exhibited positional disorder with 0.5 site-occupation factors.
- Asymmetrical arrangement and chair conformations of morpholino groups were observed.
- A one-dimensional chain structure was formed through C-H⋯π interactions.
Conclusions:
- The study provides detailed structural insights into C(24)H(39)N(3)O(3).
- The findings highlight the role of disorder and specific conformations in crystal packing.
- Intermolecular C-H⋯π interactions are key to the observed one-dimensional supramolecular architecture.
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