含有甲的三醇和化物之间的双极促进和大小依赖的合作性导致持久的化的三明治复合物
Yongjun Li1, Maren Pink, Jonathan A Karty
1Department of Chemistry, Indiana University, Bloomington, 800 East Kirkwood Avenue, Bloomington, Indiana 47405, USA.
含有甲基的三醇最好与化物形成2:1的三明治复合物. 这种增强的结合,特别是与的结合,是由复杂结构内的特定双极相互作用驱动的.
科学领域:
- 超分子化学 超分子化学
- 主机和客人的化学反应
- 有机合成 有机合成
背景情况:
- 特里亚佐洛是能够结合客人的宏环宿主.
- 之前的研究集中在基于的三醇.
- 异质原子在宏循环结合中的作用是一个感兴趣的领域.
研究的目的:
- 为了研究三醇的复杂化行为,与化离子结合化子单位.
- 了解2:1三明治复合体形成的结构和电子因素.
- 为了比较与不同化物客体的结合亲和力和合作力.
主要方法:
- 合成含有的三醇.
- 频谱分析,包括1H NMR,以表征复杂结构.
- 使用电位计定位或类似方法确定约束常数.
- 计算建模以了解相互作用.
主要成果:
- 化三醇对与化离子形成2:1三明治复合物的强烈偏好.
- 结合常数表明:1:1复合物的不稳定是由于酸单双的原因.
- 一小时的NMR数据证实了特定的pi-stacked形状与面向内部的化二极体.
- 在结合中观察到积极的合作性,化物表现出最高效应.
结论:
- 三醇中的化基子单元通过有利的双极相互作用增强了2:1三明治复合物的形成.
- 在pi堆叠结构中,双极的方向对于复杂的稳定性至关重要.
- 化物大小影响合作性的程度,化物表现出显著的积极合作性.
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