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铜(II)与L-高丝氨酸和1,10-菲咯啉配位化合物的溶剂化异构多样性:合成、晶体结构及电子自旋共振研究

Solvatomorphic Diversity in Coordination Compounds of Copper(II) with l-Homoserine and 1,10-Phenanthroline: Syntheses, Crystal Structures and ESR Study.

作者信息

Vušak Darko, Šimunović Letić Marta, Tašner Marina, Matković-Čalogović Dubravka, Jurec Jurica, Žilić Dijana, Prugovečki Biserka

机构信息

Department of Chemistry, Faculty of Science, University of Zagreb, Horvatovac 102A, HR-10000 Zagreb, Croatia.

Laboratory for Magnetic Resonances, Division of Physical Chemistry, Ruđer Bošković Institute, Bijenička Cesta 54, HR-10000 Zagreb, Croatia.

出版信息

Molecules. 2024 Nov 27;29(23):5621. doi: 10.3390/molecules29235621.

DOI:10.3390/molecules29235621
PMID:39683780
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC11643913/
Abstract

In this study, we report the syntheses, crystal structures and magnetic properties of ternary copper(II) coordination compounds with l-homoserine (l-Hhser) and 1,10-phenanthroline (phen). Six new coordination compounds were obtained: [Cu(l-hser)(HO)(phen)]SO·5HO (), [Cu(μ-l-hser)(HO)(phen)]Cu(l-hser)(HO)(phen)∙12HO (), {[Cu(μ-l-hser)(HO)(phen)][Cu(μ-l-hser)(phen)]SO·6HO} (), {[Cu(μ-l-hser)(HO)(phen)]SO·3HO} (), [Cu(l-hser)(HO)(phen)][Cu(l-hser)(CHOH)(phen)]SO·4HO () and {[Cu(l-hser)(CHOH)(phen)][Cu(μ-l-hser)(phen)]SO·5CHOH} () It was shown that slight differences in water content in the synthetic mixtures highly influence the final product, so in some cases, two or three different products were obtained. The compounds were characterized by single-crystal X-ray diffraction and ESR spectroscopy. Crystal packings are based on intensive networks of hydrogen bonds and π interactions. Most water solvent molecules in these microporous compounds are found in discrete pockets (, , , ). In , water molecules are packed in pockets and 1D channels and in methanol solvent molecules form 1D channels. ESR spectroscopy measured from room down to liquid nitrogen temperature was used for local magnetic characterization of copper centers. The spin Hamiltonian parameters obtained from the spectral simulation revealed copper coordination geometry that is in agreement with the structural results. Furthermore, ESR spectra revealed no significant exchange coupling between copper ions. showed pronounced antiproliferative activity toward human colon cancer cell lines (HCT116), human breast cancer cell line (MCF-7) and human lung cancer cell lines (H460).

摘要

在本研究中,我们报道了三元铜(II)配位化合物与L-高丝氨酸(L-Hhser)和1,10-菲咯啉(phen)的合成、晶体结构和磁性。得到了六种新的配位化合物:[Cu(L-hser)(H₂O)(phen)]SO₄·5H₂O (), [Cu(μ-L-hser)(H₂O)(phen)]Cu(L-hser)(H₂O)(phen)₂∙12H₂O (), {[Cu(μ-L-hser)(H₂O)(phen)][Cu(μ-L-hser)(phen)]SO₄·6H₂O} (), {[Cu(μ-L-hser)(H₂O)(phen)]SO₄·3H₂O} (), [Cu(L-hser)(H₂O)(phen)][Cu(L-hser)(CH₃OH)(phen)]SO₄·4H₂O () 和 {[Cu(L-hser)(CH₃OH)(phen)][Cu(μ-L-hser)(phen)]SO₄·5CH₃OH} ()。结果表明,合成混合物中含水量的微小差异对最终产物有很大影响,因此在某些情况下,会得到两种或三种不同的产物。这些化合物通过单晶X射线衍射和电子顺磁共振光谱进行了表征。晶体堆积基于氢键和π相互作用的密集网络。这些微孔化合物中的大多数水溶剂分子存在于离散的口袋中(, ,, )。在 中,水分子填充在口袋和一维通道中,而在 中,甲醇溶剂分子形成一维通道。从室温到液氮温度测量的电子顺磁共振光谱用于铜中心的局部磁性表征。从光谱模拟中获得的自旋哈密顿参数揭示了与结构结果一致的铜配位几何结构。此外,电子顺磁共振光谱显示铜离子之间没有明显的交换耦合。 对人结肠癌细胞系(HCT116)、人乳腺癌细胞系(MCF-7)和人肺癌细胞系(H460)表现出明显的抗增殖活性。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/4df5ce057a19/molecules-29-05621-g006.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/dac1d3a2b4c1/molecules-29-05621-g001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/3e4413034580/molecules-29-05621-g002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/932e037ccc1d/molecules-29-05621-g003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/ef64843a3d12/molecules-29-05621-g004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/757259f046da/molecules-29-05621-g005.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/4df5ce057a19/molecules-29-05621-g006.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/dac1d3a2b4c1/molecules-29-05621-g001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/3e4413034580/molecules-29-05621-g002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/932e037ccc1d/molecules-29-05621-g003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/ef64843a3d12/molecules-29-05621-g004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/757259f046da/molecules-29-05621-g005.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/91ac/11643913/4df5ce057a19/molecules-29-05621-g006.jpg

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