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Stability of fullerene complexes with oxazoles as biologically active compounds
Applied Nanoscience Pub Date : 2019-11-30 , DOI: 10.1007/s13204-019-01225-9
Nataliya Obernikhina , Maryna Zhuravlova , Oleksiy Kachkovsky , Olexandr Kobzar , Volodymyr Brovarets , Olena Pavlenko , Mykola Kulish , Oksana Dmytrenko

The ability of fullerene to form stable π → π-complexes was studied by quantum-chemical methods and the fluorescence quenching of reference dye (thiochrome). The correlation between the theoretically calculated and experimentally obtained energy of the π → π-complexes was determined. The energy of the stack interaction between fullerene and some biological active compounds, derivatives of 1,3-oxazoles, containing donor/acceptor substituents was estimated.

中文翻译:

富勒烯与恶唑作为生物活性化合物的配合物的稳定性

通过量子化学方法和参考染料(硫色素)的荧光猝灭研究了富勒烯形成稳定的π→π复合物的能力。确定了π→π络合物的理论计算能量和实验获得能量之间的相关性。富勒烯与某些生物活性化合物(包含供体/受体取代基的1,3-恶唑衍生物)之间的相互作用的能量进行了估算。
更新日期:2019-11-30
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