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Synthesis and Crystal Structure of 9-Pyridyl-1,8-dioxo-2,3,4,5,6,7-hexahydroxanthene
引用本文:ZHAO Qing-Jiea LIN Hai-Xiaa② HAN Naa CHEN Min-Qinb YANG Ming-Faa a (Department of Chemistry,Shanghai University,Shanghai 200436,China) b (Research Center of Analysis and Measurement,Fudan University,Shanghai 200433,China). Synthesis and Crystal Structure of 9-Pyridyl-1,8-dioxo-2,3,4,5,6,7-hexahydroxanthene[J]. 结构化学, 2005, 24(6): 701-705
作者姓名:ZHAO Qing-Jiea LIN Hai-Xiaa② HAN Naa CHEN Min-Qinb YANG Ming-Faa a (Department of Chemistry  Shanghai University  Shanghai 200436  China) b (Research Center of Analysis and Measurement  Fudan University  Shanghai 200433  China)
作者单位:ZHAO Qing-Jiea LIN Hai-Xiaa② HAN Naa CHEN Min-Qinb YANG Ming-Faa a (Department of Chemistry,Shanghai University,Shanghai 200436,China) b (Research Center of Analysis and Measurement,Fudan University,Shanghai 200433,China)
基金项目:The work was supported by the Development Foundation of Ministry of Education of Shanghai
摘    要:1 INTRODUCTION The Koevenagel condensation catalyzed by bases or Lewis acid has been the subject of many synthetic applications since its discovery[1] although the pre- sence of catalyst is not always indispensable[2]. Mo- reover, the reaction of aromatic aldehyde with 1,3- cyclohexanedione under different conditions afforded different products[3~6]. In continuing efforts for the application of 1,3-cyclohexanedione derivatives to construct new heterocycles with biological activi- ties[7…

关 键 词:晶体结构  合成方法  9-氮苯基-1,8-二氧代-2,3,4,5,6,7-六氧杂蒽  X射线分析

Synthesis and Crystal Structure of 9-Pyridyl-1,8-dioxo-2,3,4,5,6,7-hexahydroxanthene
ZHAO Qing-jie,LIN Hai-Xia,HAN Na,CHEN Min-Qin,YANG Ming-Fa. Synthesis and Crystal Structure of 9-Pyridyl-1,8-dioxo-2,3,4,5,6,7-hexahydroxanthene[J]. Chinese Journal of Structural Chemistry, 2005, 24(6): 701-705
Authors:ZHAO Qing-jie  LIN Hai-Xia  HAN Na  CHEN Min-Qin  YANG Ming-Fa
Abstract:9-Pyridyl-1,8-dioxo-2,3,4,5,6,7-hexahydroxanthene 3 (C18H17NO3) was prepared by the reaction of 4-pyridinecarboxaldehyde and 1,3-cyclohexanedione using Nafion-H as catalyst. The crystal and molecular structures were studied. The crystal is of orthorhombic, space group Pbcn with a = 20.369(4), b = 14.528(2), c = 9.747(17) (A), V = 2884.3(9) (A)3, Dc = 1.360 g/cm3, Z = 8, F(000) = 1248 and μ(MoKα) = 0.093 mm-1. The final R = 0.0395, wR = 0.1087 for 1458 observed reflections (I > 2σ(I)), and R = 0.1032, wR = 0.1340 for all 2580 reflections. The outer rings of the xanthene groups adopt an almost ideal envelope conformation, and the heterocyclic central ring exhibits a distorted boat conformation. The pyridyl group is rotated with respect to the xanthene system by 87°.
Keywords:crystal structure   xathene   preparation
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