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Updated: Jul 5, 2025

Vibrational Spectra of a N719-Chromophore/Titania Interface from Empirical-Potential Molecular-Dynamics Simulation, Solvated by a Room Temperature Ionic Liquid
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Vibrational Spectra of a N719-Chromophore/Titania Interface from Empirical-Potential Molecular-Dynamics Simulation, Solvated by a Room Temperature Ionic Liquid

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托尼试剂中的结合强度和相互作用能量:从基于分子静电电位的参数的洞察力

Remya Lohithakshamenon1, Kavanal P Prasanthkumar2, Cherumannil Femina1

  • 1Department of Chemistry, Farook College, Kozhikode 673632, India.

The journal of physical chemistry. A
|January 22, 2024
PubMed
概括

超价 (III) 托尼试剂是有效的三甲基化剂. 在I-CF3组的碳原子上的分子静电电位 (MESP) 量化了电子影响,预测了试剂的反应性和相互作用.

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