| Synthesis and Crystal Structure of（S）-N-（hexahydro-2-oxo-1H-azepin-3-yl）-3-phenyl-2-propenamide |
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| 引用本文： | 李小林,方正,张峰,曾文波,郭凯.Synthesis and Crystal Structure of（S）-N-（hexahydro-2-oxo-1H-azepin-3-yl）-3-phenyl-2-propenamide[J].结构化学,2014,33(6):50-53. |
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| 作者姓名： | 李小林 方正 张峰 曾文波 郭凯 |
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| 作者单位： | [1]School of Pharmaceutical Sciences, Nanjing University of Technology, Nanjing 211816, China; [2]College of Biotechnology and Pharmaceutical Engineering,Nanjing University of Technology, Nanjing 211816, China |
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| 基金项目： | Supported by the National Key Basic Research Program of China(973 Program)(2012CB725204 and 2012CB721104);the Natural Science Foundation of Jiangsu Province(No.BK20130913);Program for Changjiang Scholars and Innovative Research Team in University(No.IRT1066);the Priority Academic Program Development of Jiangsu Higher Education Institution |
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| 摘 要： | The title compound(S)-N-(hexahydro-2-oxo-1H-azepin-3-yl)-3-phenyl-2-propenamide(C15H18N2O2, Mr = 258.31) was synthesized by the reaction of(S)-α-amino-ε-caprolactam with 3-phenyl-2- propenoyl chloride. Its chemical structure was determined by 1H NMR, 13C NMR, H RMS and X-ray single-crystal diffraction. The crystal belongs to the monoclinic system, space group P21/n with a = 14.957(3), b = 4.884(1), c = 18.630(4), β = 95.91(3)o, V = 1353.7(5)3, Z = 4, Dc = 1.267 g/cm3, μ = 0.085 mm-1, F(000) = 552, R = 0.0671 and wR = 0.1547 for 2473 observed reflections with I 2σ(I).
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| 关 键 词： | 晶体结构 丙烯酰胺 苯基 合成 氮杂 氧代 X射线单晶衍射 氢 |
Synthesis and Crystal Structure of(S)-N-(hexahydro-2-oxo-1H-azepin-3-yl)-3-phenyl-2-propenamide |
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| LI Xiao-Lin
,
FANG Zheng
,
ZHANG Feng
,
ZENG Wen-Bo
,
GUO Kai.Synthesis and Crystal Structure of(S)-N-(hexahydro-2-oxo-1H-azepin-3-yl)-3-phenyl-2-propenamide[J].Chinese Journal of Structural Chemistry,2014,33(6):50-53. |
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| Authors: | LI Xiao-Lin FANG Zheng ZHANG Feng ZENG Wen-Bo GUO Kai |
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| Institution: | 1. School of Pharmaceutical Sciences, Nanjing University of Technology, Nanjing 211816, China
2. College of Biotechnology and Pharmaceutical Engineering,Nanjing University of Technology, Nanjing 211816, China |
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| Abstract: | synthesis,propenamide,caprolactam,crystal structure |
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| Keywords: | synthesis propenamide caprolactam crystal structure |
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