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Synthesis and Crystal Structure of Methyl 2-(Diphenylamino)-4-phenyl-1,3-thiazole-5-carboxylate |
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| Authors: | Ali Souldozi Seyed Hamid Reza Shojaei Ali Ramazani Katarzyna lepokura Tadeusz Lis |
| Institution: | 1. Department of Chemistry, Urmia Branch, Islamic Azad University, P.O. Box 969, Urmia, Iran 2. Department of Physics, Urmia Branch, Islamic Azad University, P.O. Box 969, Urmia, Iran 3. Department of Chemistry, Zanjan Branch, Islamic Azad University, P.O. Box 49195-467, Zanjan, Iran 4. Faculty of Chemistry, University of Wroclaw, 14 Joliot-Curie St., 50-383 Wroclaw, Poland |
| Abstract: | The title compound, methyl 2-(diphenylamino)-4-phenyl-1,3-thiazole-5-carboxylate, was synthesized and studied by single-crystal X-ray diffraction method. The structure of the product was confirmed by IR, 1H- and 13C-NMR spectroscopy and elemental analysis. These experimental studies were supported by quantum mechanical calculations. The structure was solved in monoclinic, space group P21/c with a = 9.573(3), b = 19.533(7), c = 9.876(3), β = 92.35(4)°, V = 1845.2(10)3, T = 85(2) K, Z = 4, R = 0.040 and wR = 0.089 for 6424 observed reflections with I>2σ(I). |
| Keywords: | single-crystal X-ray structure multi-component reaction methyl 2-(diphenylamino)-4-phenyl-1 3-thiazole-5-carboxylate benzoyl isothiocyanate diphenylamine dimethyl acetylenedicarboxylate |
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