مشخصات پژوهش

صفحه نخست /Synthesis, characterization, ...
عنوان Synthesis, characterization, and theoretical studies on ylidic complexes of mercury(II) as antioxidant agents
نوع پژوهش مقاله چاپ‌شده در مجلات علمی
کلیدواژه‌ها ylide Hg complex antioxidant activity DFT NBO EDA
چکیده Herein we describe the synthesis of a library of new mercury complexes, including some dimers and polymeric species. Initially, a phosphonium salt, [PPh3CH2C(O)C6H4–m-OCH3]Br (S), was synthesized from triphenylphosphine (PPh3) and BrCH2C(O)C6H4-m-OCH3 in acetone. We then reacted this phosphonium salt with an appropriate base to acquire a new phosphorus ylide monodentate, PPh3=C(H)C(O)C6H4-m-OCH3 (Y). Finally, we treated the synthesized ligand with mercury halides in dry CH3OH to form C-coordinated complexes of the form [HgX(PPh3C(H)C(O)C6H4-m-OCH3) (μ-X)]2 [X = Cl (1), Br (2), I (3)], [(PPh3=C(H)C(O)C6H4-m-OCH3)Hg(NO3)2]n (4). We characterized these compounds using CHN analysis, FT-IR, NMR (1H, 13C and 31P) and density functional theory. We elucidated the structure of 2 by single-crystal X-ray diffraction. The results establish that 1, 2 and 3 have dimeric structures, while a polymeric structure is suggested for 4. The antioxidant activity of all compounds in DMSO was assessed using a DPPH free radical scavenging method. Also, the nature of metal-ligand (C→Hg) bonding in 1, 2 and 3 have been investigated using natural bond orbital (NBO) and energy-decomposition analyses (EDA).
پژوهشگران فائزه منیریان (نفر اول)، سیدجواد سیدزاده صابونچی (نفر دوم)، خدیجه بادپای (نفر سوم)، مهدی بیات (نفر چهارم)، الهام سلطانی (نفر پنجم)، رویا کرمیان (نفر ششم به بعد)، مصطفی اسدبیگی (نفر ششم به بعد)، سیدحامد معظمی فریدا (نفر ششم به بعد)، رابرت گیبل (نفر ششم به بعد)