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Journal of Chemical Crystallography

, Volume 49, Issue 3, pp 181–185 | Cite as

Synthesis and Crystal Structure of (E)-2-(3,4,5-Trimethoxystyryl)-5-nitrobenzenesulfonate Pyrrolidinium

  • Bo LiangEmail author
  • Wen-Ting Ji
  • Sheng-Hui Wang
  • Ting-Ting Hu
Article

Abstract

A new compound was synthesized from 2-methyl-5-nitrobenzenesulfonic acid and 3,4,5-trimethoxybenzaldehyde via two steps, including neutralization reaction and condensation reaction. It was analyzed by IR, MS, and NMR spectrum. The crystal structure has been determined by means of single-crystal X-ray diffraction method. It crystallizes in the triclinic space group P-1 with unit cell parameters: a = 7.240(3) Å, b = 11.289(5) Å, c = 14.134(6) Å, α = 87.750(15)°, β = 85.638(13)°, γ = 81.904(13)° and Z = 2. The asymmetric units consist of one C17H16NO8S anion, one C4H8NH2+ cation, and one water molecule. The crystal structure is stabilized by the two kinds of offset π···π stacking and four kinds of intermolecular hydrogen bonding. These interactions extend the molecule structure to three dimensional frameworks.

Graphical Abstract

A new compound was examined by X-ray single crystal diffraction. The asymmetric units consist of one C17H16NO8S anion, one C4H8NH2+ cation, and one water molecule. The crystal structure is stabilized by the two kinds of offset π···π stacking and four kinds of intermolecular hydrogen bonding. These interactions extend the molecule structure to three dimensional frameworks.

Keywords

π···π stacking Hydrogen bonding Crystal structure 

Notes

Acknowledgements

This work was supported by Education Department of Shaanxi Province (No. 2017sxjy001).

Supplementary material

10870_2019_784_MOESM1_ESM.docx (1.9 mb)
Supplementary material 1 (DOCX 1943 kb)

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Copyright information

© Springer Science+Business Media, LLC, part of Springer Nature 2019

Authors and Affiliations

  1. 1.School of Chemistry and EngineeringAnkang UniversityAnkangChina

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