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Updated: Sep 14, 2025

Microscopic Visualization of Porous Nanographenes Synthesized through a Combination of Solution and On-Surface Chemistry
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Published on: March 4, 2021

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非共价C─H Au债券与C─H π债券可比吗? 一个理论视角

Sergi Burguera1, Antonio Bauzá1

  • 1Departament de Química, Universitat de les Illes Balears, Ctra. de Valldemossa km 7.5, Palma de Mallorca, 07122, Spain.

Chemistry, an Asian journal
|July 24, 2025
PubMed
概括

本研究理论上使用计算方法比较C−H···Au和C−H···π债券. 研究结果揭示了基结构如何影响这些非共价相互作用,这对超分子化学和材料科学至关重要.

关键词:
C─H···Au 和 C─H···π 相互作用在DFT-D3研究中.在EDA研究中,研究人员对EDA进行了研究.在QTAIM和NCIplot分析中,超分子化学 超分子化学

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