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Structure Study on N-Phenyl-2-deoxy-D-ribopyranosylamine

Structure Study on N-Phenyl-2-deoxy-D-ribopyranosylamine
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摘要 The title compound N-phenyl-2-deoxy-D-ribopyranosylamine featuring a single conformation and pyranose-ring has been synthesized and characterized by NMR spectrum and X-ray diffraction. X-ray crystal structure analysis shows that its crystal belongs to the monoclinic system, space group P21 with a = 6.5375(9), b = 7.7140(9), c = 10.7865(16)A, β= 97.578(11)^o, Z = 2, V= 539.22(13)A^3, Dc = 1.289 g/cm^3, F(000) = 224, μ(MoKa) --- 4.533 mm^-1, R = 0.0305 and wR = 0.0639 for 1093 observed reflections (I 〉 2σ(I). This compound exists as a-conformation and ^1C4 chair-like configuration. The title compound N-phenyl-2-deoxy-D-ribopyranosylamine featuring a single conformation and pyranose-ring has been synthesized and characterized by NMR spectrum and X-ray diffraction. X-ray crystal structure analysis shows that its crystal belongs to the monoclinic system, space group P21 with a = 6.5375(9), b = 7.7140(9), c = 10.7865(16)A, β= 97.578(11)^o, Z = 2, V= 539.22(13)A^3, Dc = 1.289 g/cm^3, F(000) = 224, μ(MoKa) --- 4.533 mm^-1, R = 0.0305 and wR = 0.0639 for 1093 observed reflections (I 〉 2σ(I). This compound exists as a-conformation and ^1C4 chair-like configuration.
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 北大核心 2007年第12期1476-1480,共5页 结构化学(英文)
基金 Project supported by the National Natural Science Foundation of China (No. 20132020)
关键词 N-phenyl-2-deoxy-D-ribopyranosylamine quantum chemical calculation Chair-conformation X-ray crystal structure N-phenyl-2-deoxy-D-ribopyranosylamine, quantum chemical calculation, Chair-conformation, X-ray, crystal structure
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