4-(4-tert-丁--) -1-新-1,2,4-三化物
Daniel R Albert1, Michael Gau2, Edward Rajaseelan1
1Department of Chemistry Millersville University,Millersville PA 17551 USA.
IUCrData
|March 17, 2025
概括
这项研究详细介绍了1,2,4-三盐的晶体结构. 该结构揭示了特定的分子间相互作用,涉及盐之间的键.
科学领域:
- 晶体学 晶体学是指结晶学.
- 超分子化学 超分子化学
背景情况:
- 1,2,4-三盐是多用途的有机化合物.
- 了解它们的固态结构对于材料科学应用至关重要.
研究的目的:
- 为了阐明一个特定的1,2,4-化盐的晶体结构.
- 为了识别和描述晶格内部的分子间相互作用.
主要方法:
- 使用单晶X射线衍射来确定晶体结构.
- 对晶体结构的分析确定了关键的分子间接触.
主要成果:
- 1,2,4-三盐,C18H28N3+·Br−,在单临床空间组Pc中结晶.
- 在异环C-H组和化物离子 (HBr = 2.57 Å) 之间观察到显著的分子间相互作用.
- 还确定了涉及其他异环C-H和基C-H组与化物离子的较弱相互作用.
结论:
- 晶体包装受特定的结合相互作用的影响.
- 这些相互作用有助于1,2,4-三盐在固态中的整体稳定性和性能.
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