在酸二元体中的无和和振动的斯特克场
Manjusha Boda1, Arzoo1, G Naresh Patwari1
1Department of Chemistry, Indian Institute of Technology Bombay, Mumbai 400076, India. naresh@chem.iitb.ac.in.
酸通过结形成稳定的循环二次体,比碳酸更强. 这种增强的稳定性与电场对OH组的影响和显著的不和性有关.
科学领域:
- 化学 化学 化学
- 物理化学 物理化学
- 频谱学是一种光谱学.
背景情况:
- 酸通过分子间的键形成独特的循环二元体形成.
- 这些二元体显示出异常稳定性和较高的二元化度与相似的碳酸二元体相比.
- 这些二极体中的键强度可以通过评估电场来量化.
研究的目的:
- 为了研究酸二聚体中结的强度.
- 为了比较酸二次体与碳酸二次体的键特性.
- 探索电场和振动频率转移之间的关系.
主要方法:
- 评估电场沿着结OH供体组的电场.
- 对OH拉伸振动频率转移的分析.
- 测量主要和次要替代效应的 Stark 调整速率.
- 协调和不协调的O-D频率转移的比较.
主要成果:
- 在OH拉伸振动频率和电场之间观察到线性相关性.
- 酸二次体表现出比碳酸二次体 (21.9 和 5.7 厘米) 高的斯特克调率 (45.6 和 11.8 厘米-1) 和MV 厘米-1).
- 与波转移相比,无波O-D频率转移显示了显著更高的斯特克调节率 (40-50%的增加).
结论:
- 酸二元体具有比碳酸二元体更强的联相互作用.
- 电场评估是研究这些系统中键强度的有效方法.
- 结果表明,酸二次体的O-H/O-D振荡器中存在显著的不协调性.
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