尝试在双乙酰丙酮酸香草酯的第六个(轴向)位置添加配体:一种独特的四核香草醛物种

R. Lalancette, Ivan Bernal
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引用次数: 0

摘要

我们探索了[(acac)2V=O](acac = 乙酰丙酮)与一系列潜在配体的相互作用,之所以选择这些配体,是因为预期它们能够附着在[(acac)2V=O]的第六(轴向)位置上。此外,所选的一些配体还具有连接成对[(acac)2V=O]分子的能力,从而产生磁性耦合物质,这些物质的行为值得通过磁性和结构方法进行记录。一些合成结果令人惊讶,因为我们得到了意想不到的产物,而这些产物是我们未曾预料到的;特别是,我们在此描述了一个四核钒钛簇合物(C38H51N4O17ClV4 的晶体数据:正交,空间群 Pca21(no.29), a = 26.4698(3) Å, b = 13.5167(2) Å, c = 12.7659(2) Å, V = 4567.44(11) Å3, Z = 4, μ(CuKα) = 7.842 mm-1,Dcalc = 1.53 g/cm3,测得 41277 个反射(6.538° ≤ 2Θ ≤ 137.892°),7841 个唯一反射(Rint = 0.0428,Rsigma = 0.0421),所有计算均采用了这些反射;最终 R1 为 0.0675(I > 2σ(I)),wR2 为 0.1641(所有数据)),这在其组成以及立体化学的多个方面都是不同寻常的。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
In an attempt to add ligands to the sixth (axial) position of vanadyl bis-acetylacetonate: A unique tetranuclear vanadyl species
We have explored the interaction of [(acac)2V=O] (acac = acetylacetone) with a series of potential ligands which were chosen because of their expected ability to attach themselves onto its sixth (axial) position. Furthermore, some of the species chosen were expected to have the capability of linking pairs of [(acac)2V=O] molecules, thus creating magnetically coupled substances whose behavior would be interesting to document by magnetic as well as structural methods. Some of the synthetic results were surprising in that unexpected products were obtained which we had not envisioned; specifically, herein we describe a tetranuclear vanadyl cluster (Crystal data for C38H51N4O17ClV4: orthorhombic, space group Pca21 (no. 29), a = 26.4698(3) Å, b = 13.5167(2) Å, c = 12.7659(2) Å, V = 4567.44(11) Å3, Z = 4, μ(CuKα) = 7.842 mm-1, Dcalc = 1.53 g/cm3, 41277 reflections measured (6.538° ≤ 2Θ ≤ 137.892°), 7841 unique (Rint = 0.0428, Rsigma = 0.0421) which were used in all calculations; the final R1 was 0.0675 (I > 2σ(I)) and wR2 was 0.1641 (all data)), which is unusual in several aspects of its composition as well as its stereochemistry.
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