f-金属配合物结构中己二酸离子的构象和配位类型

IF 1 Q4 CHEMISTRY, INORGANIC & NUCLEAR
V. N. Serezhkin, S. V. Kondrashkin, A. A. Gnedov, D. V. Pushkin, L. B. Serezhkina
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引用次数: 0

摘要

139个晶体学上不等效的己二酸离子在晶体结构中与f-金属原子表现出八种拓扑上不同的配位类型。与其他脂族二羧酸离子不同,所有类型的己二酸离子的配位都只能形成四元螯合环。本文以己二酸离子为例,测试了一种定量评价6碳单键链构象的新方法。在已知的结构中,己二酸离子有六种不同的构象,每一种构象对应一个“双”符号:φ3/φ3、φ1/φ3、φ1/φ1、φ2/φ3、φ1/φ2或φ2/φ2。在大多数情况下(≈97%的情况下),可以实现奇数trans - solid φ3和/或歪斜φ1构象在能量上更有利的组合。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Conformations and Coordination Types of Adipate Ions in the Structures of f-Metal Complexes

Conformations and Coordination Types of Adipate Ions in the Structures of f-Metal Complexes

139 crystallographically nonequivalent adipate ions exhibit eight topologically different types of coordination to f-metal atoms in the crystal structures. Unlike other aliphatic dicarboxylate ions, all types of coordination of adipate ions lead to the formation of only four-membered chelate rings. A new method for quantitatively assessing the conformation of chains containing six carbon atoms linked by single C–C bonds was tested using adipate ions as an example. In known structures, adipate ions realize six different conformations, each of which corresponds to a certain “double” symbol: φ33, φ13, φ11, φ23, φ12, or φ22. Most often (≈97% of cases), energetically more favorable combinations of odd transoid φ3 and/or skewed φ1 conformations are realized.

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来源期刊
Radiochemistry
Radiochemistry CHEMISTRY, INORGANIC & NUCLEAR-
CiteScore
1.30
自引率
33.30%
发文量
51
期刊介绍: Radiochemistry  is a journal that covers the theoretical and applied aspects of radiochemistry, including basic nuclear physical properties of radionuclides; chemistry of radioactive elements and their compounds; the occurrence and behavior of natural and artificial radionuclides in the environment; nuclear fuel cycle; radiochemical analysis methods and devices; production and isolation of radionuclides, synthesis of labeled compounds, new applications of radioactive tracers; radiochemical aspects of nuclear medicine; radiation chemistry and after-effects of nuclear transformations.
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