N,N'-Bis[tris-(hy-droxy-meth-yl) meth-yl]propane-1,3-di-amine (bis-tris propane)
Ismael Angel-Nieto1, Rosa Elena Arroyo-Carmona2, Aarón Pérez-Benítez2
1Instituto de Física Luis Rivera Terrazas, Benemérita Universidad Autónoma de Puebla, Av. San Claudio y 18 Sur, 72570 Puebla, Pue., Mexico.
IUCrData
|January 19, 2026
概括
本研究详细介绍了一种用于缓冲溶液和协调复合物的化合物的晶体结构. 曲的分子形状和结合揭示了潜在的多态,这表明这是一个不太稳定的晶体形式.
科学领域:
- 晶体学 晶体学是指结晶学.
- 化学晶体学 化学晶体学
- 材料科学 材料科学 材料科学
背景情况:
- 标题化合物C11H26N2O6是缓冲溶液和高核度协调复合物的前体.
- 了解固态结构对于其在化学合成和材料设计中的应用至关重要.
研究的目的:
- 为了阐明标题化合物的晶体结构.
- 为了研究晶格内部的分子构造和分子间相互作用.
- 为了确定潜在的多态性,并评估观察到的晶体形式的稳定性.
主要方法:
- 单晶X射线衍射分析.
- 空间组的确定 (Pnma).
- 对分子几何学,结合和晶体包装的分析.
主要成果:
- 该化合物以半分子在不对称单元中结晶,通过镜像对称完成.
- 一个曲的分子形状导致原子障碍,以防止短时间的分子内接触.
- 广泛的分子间键 (O-HN,N-HO,O-HO) 在[100]方向上形成链条.
- 确定的晶体结构很可能是一个不太稳定的多态.
结论:
- 已经确定了C11H26N2O6的晶体结构,揭示了曲的分子几何学和特定的结合模式.
- 观察到的晶体包装和潜在的障碍表明存在多重多态.
- 这些发现为该化合物的固态行为提供了洞察力,这与其在缓冲溶液和协调化学中的使用有关.
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