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Synthesis and Crystal Structure of (E)-4-(3-oxo-3-((4-(N-(pyrimidin-2-yl)-sulfamoyl)phenyl)amino)prop-1-en-1-yl)-1,2-phenylene diacetate Dimethanol 被引量:2

Synthesis and Crystal Structure of (E)-4-(3-oxo-3-((4-(N-(pyrimidin-2-yl)-sulfamoyl)phenyl)amino)prop-1-en-1-yl)-1,2-phenylene diacetate Dimethanol
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摘要 The title compound, (E)-4-(3-oxo-3-((4-(N-(pyrimidin-2-yl)sulfamoyl)-phenyl)ami- no)prop- 1-en- 1-yl)- 1,2-phenylene diacetate dimethanol, was synthesized by the reaction of caffeic acid with sulfadiazine and characterized by FT-IR, 1H-NMR spectroscopy, ESI-MS and X-ray single-crystal diffraction. It crystallizes in triclinic, space group P1 with a = 10.302(7), b = 11.621(8), c = 12.107(8)A, a = 100.904(9), β = 102.624(8), y = 95.501(9)°, V= 1374.5(15)A3, Z= 2, F(000) = 588, D,= 1.354 Mg/m3, Mr = 560.57,μ= 0.176 mm-1, 2 = 0.71073 A, the final R = 0.0666 and wR = 0.1950 for 4774 observed reflections with I 〉 2σ(I). The title compound, (E)-4-(3-oxo-3-((4-(N-(pyrimidin-2-yl)sulfamoyl)-phenyl)ami- no)prop- 1-en- 1-yl)- 1,2-phenylene diacetate dimethanol, was synthesized by the reaction of caffeic acid with sulfadiazine and characterized by FT-IR, 1H-NMR spectroscopy, ESI-MS and X-ray single-crystal diffraction. It crystallizes in triclinic, space group P1 with a = 10.302(7), b = 11.621(8), c = 12.107(8)A, a = 100.904(9), β = 102.624(8), y = 95.501(9)°, V= 1374.5(15)A3, Z= 2, F(000) = 588, D,= 1.354 Mg/m3, Mr = 560.57,μ= 0.176 mm-1, 2 = 0.71073 A, the final R = 0.0666 and wR = 0.1950 for 4774 observed reflections with I 〉 2σ(I).
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2012年第10期1497-1500,共4页 结构化学(英文)
基金 supported by the National Natural Science Foundation of China(20962002,20662001)
关键词 caffeic acid SULFADIAZINE synthesis crystal structure caffeic acid, sulfadiazine, synthesis, crystal structure
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