散射能量强制使循环蒸的乙烯二聚变
Henning Arp1, Judith Baumgartner, Christoph Marschner
1Institut für Anorganische Chemie, Technische Universität Graz, Stremayrgasse 9, A-8010 Graz, Austria.
Journal of the American Chemical Society
|March 30, 2012
概括
研究人员合成了一种具有独特 PbPb 键的循环溶解乙烯二聚体. DFT计算显示,范德瓦尔斯力,而不是直接的键,在这个有机金属化合物中将子单位保持在一起.
科学领域:
- 有机金属化学 有机金属化学
- 化学 化学
- 化学 化学 化学
背景情况:
- 器官基烯是反应性中间体,稳定性有限.
- 了解低价值主组化合物的结合和结构至关重要.
研究的目的:
- 为了合成和表征一种新型的循环蒸的乙烯二聚物.
- 为了研究二次体中Pb-Pb相互作用的性质.
主要方法:
- 通过与 (II) 化物反应的替代四烯的合成.
- 通过素抽象形成一个无基二聚体.
- 密度函数理论 (DFT) 的计算 (M06-2X,B3LYP).
主要成果:
- 得到了一个循环脱的乙烯的基添加物.
- 氨酸抽象产生了一种无基的plumbylene二聚体,具有单一的捐助者-接受者PbPb键.
- DFT计算表明范德瓦尔斯力占主导地位,稳定了二次结构.
结论:
- 合成的乙烯二聚体由分子间范德瓦尔斯力稳定.
- PbPb相互作用主要由两极化子单元之间的吸引力控制.
- 这项研究为低价值-化合物中的结合提供了新的见解.
相关概念视频
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The simplest example of a diene is 1,3-butadiene, an acyclic conjugated π system. At room temperature, the molecule exists as a mixture of s-cis and s-trans conformers by virtue of rotation around the carbon–carbon single bond. Although the s-trans isomer is more stable, the...
Characteristics of the diene
Conformation
The simplest example of a diene is 1,3-butadiene, an acyclic conjugated π system. At room temperature, the molecule exists as a mixture of s-cis and s-trans conformers by virtue of rotation around the carbon–carbon single bond. Although the s-trans isomer is more stable, the...


