量化连接物稳定主群碎片的捐赠体强度
Leon Maser1, Christian Schneider1, Lisa Vondung1
1Department of Chemistry , Philipps-Universität Marburg , Hans-Meerwein-Str. 4 , 35032 Marburg , Germany.
Journal of the American Chemical Society
|April 19, 2019
概括
和碳化合物等稳定的主要组碎片具有强烈的捐赠特性. 这项研究量化了它们的结合强度,有助于同质催化研究.
科学领域:
- 协调化学
- 有机金属化学
- 一致性催化
背景情况:
- 连接物稳定的主要组片段 (例如,碳二,碳) 显示出稳定难以捉摸的物种和同质催化物的前景.
- 通过实验量化和比较这些碎片的结合特性仍然是一个重大挑战.
研究的目的:
- 量化和比较 (III) 复合体中中心子组 (E) 的子强度.
- 作为中性供体,研究稳定 (I) 和碳 (O) 化合物的电子特性.
主要方法:
- 类型[(PEP) IrCl (((CO) H) ]^q (q = 0, +1, +2) 的 (III) 复合物的合成和特征.
- 提供者的实验量化.
- 量子化学计算以支持实验发现并探索更重的同类.
主要成果:
- 稳定 (I) 和碳 (O) 化合物作为异常强的中性供体组.
- 这些新型连接体比普通的旁观者连接体,如碳素和素,具有更高的供体强度.
- 这项研究为比较阴离子,中性和阴离子配体的供体强度提供了第一个实验和计算基础.
结论:
- 结合体稳定的和碳碎片是强大的中性捐赠体,对均质催化有价值.
- 这些素稳定型玻利和碳化合物的较重类型具有略有降低的供体特性.
- 这项工作促进了协调化学和催化的主要组元素的理解和应用.
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