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Updated: Jun 24, 2025

Characterizing Lewis Pairs Using Titration Coupled with In Situ Infrared Spectroscopy
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Published on: February 20, 2020

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丧的易斯对介导的脱化:非共价相互作用的关键作用

Himangshu Mondal1, Pratim Kumar Chattaraj2

  • 1Department of Chemistry, Indian Institute of Technology, Kharagpur, 721302, India.

Journal of molecular modeling
|June 6, 2024
PubMed
概括

这项研究通过使用挫败的易斯对 (FLP) 来计算地探索有机化物的脱化. 密度函数理论 (DFT) 揭示了关键相互作用和能量贡献,为更安全的化学合成提供了对反应机制的见解.

关键词:
激活应变模型的激活应变模型能源分解分析的分析.丧的易斯夫妇对在一起.通过脱的水分去化.非共价相互作用 非共价相互作用

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