基和2,3-基的明显折叠行为
Yinhui Liao1, Govinda Prasad Devkota1, Vipul Batra1
1Department of Chemistry & Biochemistry, Miami University, Oxford, Ohio 45056, United States.
The Journal of organic chemistry
|October 31, 2025
概括
含皮拉的聚合物称为2,3-氧烯,它们更喜欢延伸的螺旋结构而不是紧的螺旋结构. 这是由于环相互作用较弱,扩展形状的度增加,特别是在室温下.
科学领域:
- 聚合物化学 聚合物化学
- 超分子化学 超分子化学
- 有机化学 有机化学
背景情况:
- 整形烯和2,3-氧烯是结构相似的折叠聚合物和螺旋型聚合物.
- орто-phenylenes 形成紧的螺旋体与堆叠的环.
- 2,3-基烯通常采用延长的螺旋结构,没有脊柱堆叠.
研究的目的:
- 为了研究ortho-phenylenes和2,3-quinoxalinylenes之间的形状差异.
- 了解驱动这些相关聚合物系统独特螺旋行为的因素.
主要方法:
- 晶体学 晶体学是指结晶学.
- 可变温度NMR光谱学可变温度NMR光谱学
- 密度函数理论 (DFT) 的计算.
- 对具有不同和氨酸序列的短形甲基烯的研究.
主要成果:
- 在正形-烯架构中的皮拉单元表现出较弱的烯-烯相互作用,不利于面接环包装.
- 双氨酸单元增加了扩展型对象的振动.
- 对于含有pyrazine的系统,在包括室温在内的更高温度下,扩展的螺旋形状是最受欢迎的.
结论:
- 在2,3-氧烯中,对延长螺旋的形状偏好归因于减少环间相互作用和增强的振动.
- 温度在决定这些系统的螺旋形状方面起着至关重要的作用.
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