Journal of Chemical Crystallography

, Volume 39, Issue 10, pp 747–752 | Cite as

Crystal Structure of 2-Thiophenecarboxamide: A One-dimensional Tubular Structure Formed by N–H···O Hydrogen Bonds

  • John Nicolson Low
  • Antonio Quesada
  • Luís M. N. B. F. Santos
  • B. Schröder
  • Ligia R. Gomes
Original Paper
First Online:
Received:
Accepted:

Abstract

The crystal structure of 2-thoiphenecarboxamide is described. The compound crystallizes in the orthorhombic Pna21 space group with unit cell parameters a = 10.044 (3) Å, b = 14.203 (4) Å and c = 15.941 (3) Å; V = 2,274.1 (10) Å3. The asymmetric unit contains four independent molecules which are linked by N–H···O hydrogen bonds. The asymmetric unit at (x, y, z) is connected with another one, produced by the a-glide plane at 0.75 along the b-axis, that lies at (x + 0.5, −y + 1.5, z) by two N–H···O hydrogen bonds and by a C–H···O weak hydrogen bond to form a one-dimensional tube. Adjacent tubes are linked by C–H···pi interactions to form a three-dimensional framework.

Graphical Abstract

The crystal structure of 2-thiophenecarboxamide, contains four crystallographically independent molecular components in the asymmetric unit linked by four N–H···O hydrogen bonds and a weak C–H···O hydrogen bond and form a one-dimensional tube.

Keywords

2-Thiophenecarboxamide X-ray diffraction Crystal structure 
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Notes

Acknowledgments

Authors thank “Servicios Técnicos de Investigacion of Universidad de Jaén and the staff for data collection. The authors also thank Dr. Manuel Melguizo and Dr. Christopher Glidewell for helpful discussion and advice. BS thanks FCT and the European Social Fund (ESF) under the third Community Support Framework (CSF) for the award of a Ph.D. Research Grant (SFRH/BPD/38637/2007). Thanks are also due to FCT for financial support for Project POCI/QUI/61873/2004.

Supplementary material

10870_2009_9564_MOESM1_ESM.docx (14 kb)
Supplementary material 1 (DOCX 14 kb)

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Copyright information

© Springer Science+Business Media, LLC 2009

Authors and Affiliations

  • John Nicolson Low
    • 1
  • Antonio Quesada
    • 2
  • Luís M. N. B. F. Santos
    • 3
  • B. Schröder
    • 4
  • Ligia R. Gomes
    • 5
  1. 1.Department of ChemistryUniversity of AberdeenOld AberdeenScotland, UK
  2. 2.Departamento de Didáctica del las Ciencias, Edificio “Humanidades y Ciencias de Educación” (D2)Universidad de JaénJaénSpain
  3. 3.Centro de Investigação em Química, Departamento de Química, Faculdade de CiênciasUniversidade do PortoPortoPortugal
  4. 4.CICECO, Department of ChemistryUniversity of AveiroAveiroPortugal
  5. 5.CIAGEB-Faculdade de Ciências de Saúde, Escola Superior de Saúde da UFPUniversidade Fernando PessoaPortoPortugal

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