从电子密度拓扑估计Cu(II) β-二酮酸酯中Cu - o键的强度

IF 1.1 3区化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR

Russian Journal of Coordination Chemistry Pub Date : 2025-07-02 DOI:10.1134/S1070328425600226

R. E. Afaunov, I. V. Mirzaeva, S. G. Kozlova

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引用次数: 0

摘要

铜(II) β-二酮酸酯是常用的MOCVD前体，用于生产铜和含铜涂层。对于进一步开发和有针对性地设计这种类型的新前体，有一个快速间接估计Cu-O键能量的工具将是非常有用的。在这项工作中，我们寻找了Cu(II) β-二酮酸酯中Cu - o键的能量与其拓扑特征之间的相关性。已经提出了几个方程。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

Estimating Strength of Cu–O Bonds in Cu(II) β-Diketonates from Electron Density Topology

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Estimating Strength of Cu–O Bonds in Cu(II) β-Diketonates from Electron Density Topology

Copper(II) β-diketonates are popular MOCVD precursors for production of copper and copper-containing coatings. For further development and targeted design of new precursors of this type it would be very useful to have a tool for fast indirect estimation of the energy of Cu–O bonds. In this work, we have searched for correlations between the energy of Cu–O bonds in Cu(II) β-diketonates and their topological characteristics. Several equations have been proposed.

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来源期刊

Russian Journal of Coordination Chemistry 化学-无机化学与核化学

CiteScore

2.40

自引率

15.80%

发文量

审稿时长

7.2 months

期刊介绍： Russian Journal of Coordination Chemistry is a journal that publishes reviews, original papers, and short communications on all aspects of theoretical and experimental coordination chemistry. Modern coordination chemistry is an interdisciplinary science that makes a bridge between inorganic, organic, physical, analytical, and biological chemistry.