期刊文献+

Crystal Structure of Dimethylamine 3,5-Dinitrobenzoic Acid Organic Adduct

Crystal Structure of Dimethylamine 3,5-Dinitrobenzoic Acid Organic Adduct
下载PDF
导出
摘要 The title adduct (C9H11N3O6, Mr= 257.21) was synthesized and it crystallizes in orthorhombic, space group P212121 with a = 5.8835(19), b =9.517(3), c = 20.399(6) A, V= 1142.2(6) ,A^3 Z = 4, Dc= 1.496 g/cm^3, F(000) = 536,μ(MoKα) = 0.128 mm^-1, the final R = 0.0396 and wR = 0.0800 for 1047 observed reflections with I 〉 2σ(I). The compound is a 1:1 adduct of dimethylamine and 3,5-dinitrobenzoic acid which are linked by hydrogen bonds to form a two-dimensional network. The dimethylamine is protonated at the nitrogen atom with the proton from the carboxyl of 3,5- dinitrobenzoic acid. The title adduct (C9H11N3O6, Mr= 257.21) was synthesized and it crystallizes in orthorhombic, space group P212121 with a = 5.8835(19), b =9.517(3), c = 20.399(6) A, V= 1142.2(6) ,A^3 Z = 4, Dc= 1.496 g/cm^3, F(000) = 536,μ(MoKα) = 0.128 mm^-1, the final R = 0.0396 and wR = 0.0800 for 1047 observed reflections with I 〉 2σ(I). The compound is a 1:1 adduct of dimethylamine and 3,5-dinitrobenzoic acid which are linked by hydrogen bonds to form a two-dimensional network. The dimethylamine is protonated at the nitrogen atom with the proton from the carboxyl of 3,5- dinitrobenzoic acid.
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 北大核心 2006年第8期1011-1013,共3页 结构化学(英文)
基金 This work was supported by the National Natural Science Foundation of China (50572040)
关键词 dimethylamine 3 5-dinitrobenzoic acid hydrogen bond crystal structure nonlinear optical dimethylamine 3,5-dinitrobenzoic acid, hydrogen bond, crystal structure, nonlinear optical
  • 相关文献

参考文献13

  • 1Prasad,P.N.; Williams,D.J.Introduction to Nonlinear Optical Effects in Organic Molecules and Polymers.Wiley;New York 1991.
  • 2Chemla,D.S.; Zysss,J.Nonlinear Optical Properties of Organic Molecules and Crystals,Academic Press,Orlando,FL 1987.
  • 3Williams,D.J.ACS Symposium Series 1983,233.
  • 4Yi,T.; Gao,S.; Chen,X.W.; Yan,C.H.; Li,B.G.Acta Crystallogr 1998,C54,41-43.
  • 5Sheldrick,G.M.SHELX97 1997.
  • 6Kou,H.Z.; Gao,S.; Sun,B.W.; Zhang,J.Chemistry of Materials Communications 2001,13,1431-1433
  • 7Wilson,A.J.International Table for X-ray Crystallography,Vol.C 1992,Kluwer Academic Publishers.
  • 8Saenger,W.; Wagner,K.G.Acta Crystallogr.1972,B28,2237
  • 9Taylor,R.; Kennard,O.J.Am.Chem.Soc.1982,104,5063-5070.
  • 10Desiraju,G.R.Acc.Chem.Res.1996,29,441-449.

相关作者

内容加载中请稍等...

相关机构

内容加载中请稍等...

相关主题

内容加载中请稍等...

浏览历史

内容加载中请稍等...
;
使用帮助 返回顶部