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New Look on 3-Hydroxyiminoflavanone and Its Palladium(II) Complex: Crystallographic and Spectroscopic Studies Theoretical Calculations and Cytotoxic Activity

机译：3-羟基亚氨基黄酮及其钯（II）配合物的新面貌：晶体学和光谱学理论计算和细胞毒活性

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摘要

This work presents the synthesis, spectroscopic properties and single-crystal X-ray examination of the structure of 3-hydroxyiminoflavanone and its palladium complex. It presents the results of NMR (Nuclear Magnetic Resonance) spectroscopy, electron-density studies based on X-ray wavefunction refinement and theoretical calculations combined with QTAIM (Quantum Theory of Atoms in Molecules) and ELI-D (Electron Localizability Indicator) analyses. These offer an interesting new insight into the structures and behavior of flavanone and its complex, in solid state and in solution. The study also examines the cytotoxicity of the ligand and its complex against three human ovarian and lung cancer cell lines.

机译：这项工作介绍了3-羟基亚氨基黄酮及其钯配合物的合成，光谱性质和单晶X射线检查。它介绍了NMR（核磁共振）光谱学，基于X射线波函数细化的电子密度研究以及结合QTAIM（分子中的原子量子理论）和ELI-D（电子可定位性指标）分析的理论计算结果。这些提供了对黄烷酮及其络合物在固态和溶液中的结构和行为的有趣的新见解。该研究还检查了配体及其复合物对三种人类卵巢癌和肺癌细胞系的细胞毒性。

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期刊名称 Molecules
作者
Maria Kasprzak; Małgorzata Fabijańska; Lilianna Chęcińska; Leszek Szmigiero; Justyn Ochocki;
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作者单位

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年(卷),期 2016(21),4
年度 2016
页码 455
总页数 17
原文格式 PDF
正文语种
中图分类分子生物学;
关键词
palladium(II) complex 3-hydroxyiminoflavanone NMR spectroscopy X-ray crystallography X-ray wavefunction refinement cytotoxicity;

机译：钯（II）配合物;3-羟基亚氨基黄酮;NMR光谱;X射线晶体学;X射线波函数提纯;细胞毒性;

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专利

1. New Look on 3-Hydroxyiminoflavanone and Its Palladium(II) Complex: Crystallographic and Spectroscopic Studies, Theoretical Calculations and Cytotoxic Activity [J] . Kasprzak Maria, Fabijanska Malgorzata, Checinska Lilianna, Molecules . 2016,第4期

机译：3-羟基亚氨基黄酮及其钯（II）配合物的新面貌：晶体学和光谱学，理论计算和细胞毒活性
2. New Look on 3-Hydroxyiminoflavanone and Its Palladium(II) Complex: Crystallographic and Spectroscopic Studies, Theoretical Calculations and Cytotoxic Activity [J] . Maria Kasprzak, Ma?gorzata Fabijańska, Lilianna Ch?cińska, Molecules . 2016,第4期

机译：3-羟基亚氨基黄酮及其钯（II）配合物的新面貌：晶体学和光谱学，理论计算和细胞毒活性
3. New Look on 3-Hydroxyiminoflavanone and Its Palladium(II) Complex: Crystallographic and Spectroscopic Studies, Theoretical Calculations and Cytotoxic Activity [J] . Maria Kasprzak, Ma?gorzata Fabijańska, Lilianna Ch?cińska, Molecules . 2016,第4期

机译：3-羟基亚氨基黄酮及其钯（II）配合物的新面貌：晶体学和光谱学，理论计算和细胞毒活性
4. Reaction and Electronic Structure of New Palladium(II) Phosphorus-containin; Hybrid Calixphyrin Complex. Theoretical Study [C] . Noriaki Ochi, Yoshihide Nakao, Hirofumi Sato Symposium on Organometallic Chemistry . 2007

机译：新钯（II）磷含量的反应和电子结构;杂交钙舌骨复合体。理论研究
5. Reactivity studies of platinum(IV) hydroxide and methoxide complexes and the study of pincer palladium(II) complexes as potential catalysts for olefin epoxidation [D] . Smythe, Nicole 2004

机译：氢氧化铂（IV）和甲醇盐配合物的反应性研究以及钳夹钯（II）配合物作为烯烃环氧化潜在催化剂的研究
6. Synthesis crystallographic spectroscopic studies and biological activity of new cobalt(II) complexes with bioactive mixed sulindac and nitrogen-donor ligands [O] . Asia M. Shalash, Hijazi I. Abu Ali 2017

机译：具有生物活性混合舒林酸和氮供体配体的新型钴（II）配合物的合成晶体学光谱研究和生物活性
7. New Look on 3-Hydroxyiminoflavanone and Its Palladium(II) Complex: Crystallographic and Spectroscopic Studies, Theoretical Calculations and Cytotoxic Activity [O] . Maria Kasprzak, Małgorzata Fabijańska, Lilianna Chęcińska, 2016

机译：3-羟基亚氨基黄酮及其钯（II）配合物的新观点：晶体学和光谱学研究，理论计算和细胞毒活性
8. Reductive Elimination of H-H, H-CH3, and CH3-CH3 from Bis(Phosphine)Platinum(II), - Palladium(II), and -Nickel(II) Complexes: A Theoretical Study Using the SCF-X alpha-SW Method [R] . Balazs, A. C., Johnson, K. H., Whitesides, G. M. 1981

机译：从双（膦）铂（II）， - 钯（II）和-Nickel（II）配合物中还原消除H-H，H-CH3和CH3-CH3：使用sCF-Xα-sW方法的理论研究

New Look on 3-Hydroxyiminoflavanone and Its Palladium(II) Complex: Crystallographic and Spectroscopic Studies Theoretical Calculations and Cytotoxic Activity

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