动态转化时代的远程控制
Si Tong Bao1, Haoyu Jiang1, Cedric Schaack1
1Department of Chemistry, Columbia University, New York, New York 10027, United States.
Journal of the American Chemical Society
|October 4, 2022
概括
研究人员开发了一种方法来控制基于二胺 (PDI) 的双基的轴性性. 这种远程性会影响柔性子单元的螺旋性,替代剂和溶剂会影响CD信号.
科学领域:
- 有机化学
- 超分子化学
- 石眼材料
背景情况:
- 二胺 (PDI) 衍生物因其光电子特性而受到广泛研究.
- 在复杂的有机分子中控制轴性性对于开发高级功能材料至关重要.
- 双曲线具有固有的螺旋结构,具有独特的光物理性质.
研究的目的:
- 建立一种可靠的方法来操纵基于PDI的扭曲曲的动态轴性.
- 在诱导螺旋性时,研究基拉替代剂对伊米德位置的影响.
- 了解替代剂和溶剂环境在控制光学属性的作用.
主要方法:
- 基于PDI的twistacenes与奇拉替代物的合成.
- 紫外线吸收和循环二极化 (CD) 光谱.
- 进行X射线结晶学和时间依赖密度函数理论 (TDDFT) 计算.
主要成果:
- 在以PDI为基础的双中,基替代剂成功诱导和控制性.
- 远程性有效地决定了柔性[4]子单元的螺旋形状.
- 奇拉替代剂和溶剂极性都显著影响CD信号的信号和强度.
- DFT计算表明,性群体的固态相互作用是诱导首选螺旋性的关键.
结论:
- 已经证明了在PDI转折中控制动态轴性的强有力的策略.
- 这些发现提供了灵活的性系统中控制螺旋性感应的结构属性关系的见解.
- 这项工作为设计具有可调节性质的新光电子材料开辟了道路.
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