Please use this identifier to cite or link to this item: https://dspace.ctu.edu.vn/jspui/handle/123456789/67900
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dc.contributor.authorNguyen, Trung Huy-
dc.contributor.authorNguyen, Van Trang-
dc.contributor.authorNguyen, Thi Xuyen-
dc.contributor.authorCao, Thi Hong-
dc.contributor.authorVo, Thi Kieu Anh-
dc.contributor.authorVu, Quoc Thai-
dc.contributor.authorBui, Van Cuong-
dc.contributor.authorTran, Thi Thanh Van-
dc.contributor.authorNguyen, Van Trang-
dc.contributor.authorTran, Dai Lam-
dc.contributor.authorNguyen, Thi Hoan-
dc.contributor.authorPhan, Thi Thuy-
dc.contributor.authorTrinh, Quang Dung-
dc.date.accessioned2021-11-02T03:02:34Z-
dc.date.available2021-11-02T03:02:34Z-
dc.date.issued2021-
dc.identifier.issn2525-2518-
dc.identifier.urihttps://dspace.ctu.edu.vn/jspui/handle/123456789/67900-
dc.description.abstractThe molecular properties of apigenin, luteolin and nevadensin which are three naturally flavonoid compounds have been studied theoretically by DFT method at 6-311++G(d,p) level. All FMO analysis, mechanism, and kinetics studied suggested that compound luteolin (3) was a promising antioxidant agent. The results indicated that HAT is thermodynamically preferred in the gas phase, and SPLET is the thermodynamically favorable pathway in methanol and water.vi_VN
dc.language.isoenvi_VN
dc.relation.ispartofseriesVietnam Journal of Science and Technology;Vol.59, No.01 .- P.19-29-
dc.subjectDFTvi_VN
dc.subjectFlavonoidsvi_VN
dc.subjectHATvi_VN
dc.subjectSET-PTvi_VN
dc.subjectSPLETvi_VN
dc.subjectAntioxindantvi_VN
dc.titleStudies on the antioxidant activity of apigenin, luteolin and nevadensin using DFTvi_VN
dc.typeArticlevi_VN
Appears in Collections:Vietnam journal of science and technology

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