在共振和分体反应中使用超快电子衍射直接确定键结构
Ramesh Srinivasan1, Jonathan S Feenstra, Sang Tae Park
1Laboratory for Molecular Sciences, Arthur Amos Noyes Laboratory of Chemical Physics, California Institute of Technology, Pasadena, California 91125, USA.
Journal of the American Chemical Society
|February 26, 2004
概括
我们使用超快速电子衍射研究了乙乙烯中的-二醇复合体. 乙醇形成的形式.
科学领域:
- 物理化学 物理化学
- 分子光谱学 分子光谱学
- 化学物理 化学物理
背景情况:
- 乙酸乙存在于基托和醇分体形式.
- 了解体平衡对于反应机制至关重要.
- 内分子键影响分子结构和性质.
研究的目的:
- 为了阐明乙乙的-二醇双相平衡.
- 为了确定基托和乙醇形式的精确结构.
- 为了研究酸乙中分子内键的性质.
主要方法:
- 使用了超快电子衍射 (UED).
- UED提供时间解析的结构信息.
- 进行了结构改进,以分析键.
主要成果:
- 埃诺基结构显示了部分pi-共振脱局.
- 骨的几何结构不是对称的.
- 内部分子O-H...O键是局部的和不对称的由于长的O...O距离.
结论:
- 酸乙中键是局部的和不对称的.
- 这一发现提供了对共振定体系统中结的新见解.
- UED是研究短暂分子结构和动态的强大工具.
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