کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
1403174 1501779 2013 8 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Synthesis, characterization, electronic structure and catalytic activity of new ruthenium carbonyl complexes of N-[(2-pyridyl)methylidene]-2-aminothiazole
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی آلی
پیش نمایش صفحه اول مقاله
Synthesis, characterization, electronic structure and catalytic activity of new ruthenium carbonyl complexes of N-[(2-pyridyl)methylidene]-2-aminothiazole
چکیده انگلیسی

Reaction of ruthenium carbonyls, [Ru(CO)2Cl2]n/[Ru(CO)4I2] with bidentate Schiffs base ligands derived by the condensation of pyridine-2-carboxaldehyde with 2-aminothiazole in a 1:1 mole ratio in acetonitrile led to the formation of complexes having general formula [Ru(CO)2(L)X2] (X = Cl (1) and I (2)) (L = N-[(2-pyridyl)methylidene]-2-aminothiazole). The compounds have been characterized by various analytical and spectroscopic (IR, electronic and 1H NMR) studies. In acetonitrile solution the complexes exhibit a weak broad metal–ligand to ligand charge transfer (MLLCT) band along with ILCT transitions. The compounds are emissive in room temperature upon excitation in the ILCT band. The complexes exhibit a quasi-reversible one electron Ru(II)/Ru(III) oxidation couple at 1.44 V for 1 and 0.94 V for 2. Catalytic activity of these compounds is investigated to the oxidation of PhCH2OH to PhCHO, 2-butanol (C4H9OH) to 2-butanone, 1-phenylethanol (PhC2H4OH) to acetophenone, cyclopentanol (C5H9OH) to cyclopentanone, cyclohexanol to cyclohexanone, cycloheptanol to cycloheptanone and cycloctanol to cycloctanone using N-methylmorpholine-N-oxide (NMO) as oxidant. The catalytic efficiency of 2 is greater than complex 1 and well correlate with the metal oxidation potential of the complexes. DFT, NBO and TDDFT calculations are employed to explain the structural and electronic features and to support the spectroscopic assignments.


► Ruthenium carbonyl complexes with Schiff base ligands containing thiazole moiety.
► Synthesis and spectral characterization.
► X-ray and electronic structure.
► Catalytic activity.
► DFT and TD DFT calculations.

ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Molecular Structure - Volume 1035, 13 March 2013, Pages 277–284
نویسندگان
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