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Structural Characterization of a New Chalcone Compound Containing a Thiophene Moiety: (E)-3-(5-Bromothiophen-2-YL)-1- (2,5-Dichlorothiophen-3-YL)-2-Propen-1-One

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Abstract

The crystal structure of the new chalcone derivative (E)-3-(5-bromothiophen-2-yl)-1-(2,5-dichlorothiophen- 3-yl)-2-propen-1-one is synthesized and structurally characterized by spectroscopic IR, NMR, and HRMS techniques. Its crystal and molecular structure is determined from the single crystal X-ray diffractionstudy. This compound crystallizes in the monoclinic system and space group P21/n (N 19). The crystal packing is governed by C—H...O non-conventional hydrogen bond-type intermolecular interactions, forming extended zigzag chains related by 21 screw axes running along the [010] direction, with graph-set C(8). These hydrogen bonds contribute to the stabilization of the crystal structure that packs with an efficiency of 71.4%.

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Authors and Affiliations

  1. Laboratorio de Cristalografía, Departamento de Química, Facultad de Ciencias, Universidad de Los Andes, Mérida, Venezuela

    G. E. Delgado

  2. Grupo de Investigación en Química Estructural, Escuela de Química, Facultad de Ciencias, Universidad Industrial de Santander, Bucaramanga, Colombia

    J. A. Henao & J. H. Quintana

  3. Department of Chemistry, Faculty of Science, Universiti Teknologi Malaysia, Johor, Malaysia

    H. M. Al-Maqtari, J. Jamalis & H. M. Sirat

Authors
  1. G. E. Delgado
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  2. J. A. Henao
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  3. J. H. Quintana
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  4. H. M. Al-Maqtari
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  5. J. Jamalis
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  6. H. M. Sirat
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Corresponding author

Correspondence to G. E. Delgado.

Additional information

Original Russian Text © 2018 G. E. Delgado, J. A. Henao, J. H. Quintana, H. M. Al-Maqtari, J. Jamalis, H. M. Sirat.

The text was submitted by the authors in English. Zhurnal Strukturnoi Khimii, Vol. 59, No. 6, pp. 1493–1498, July-August, 2018.

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Delgado, G.E., Henao, J.A., Quintana, J.H. et al. Structural Characterization of a New Chalcone Compound Containing a Thiophene Moiety: (E)-3-(5-Bromothiophen-2-YL)-1- (2,5-Dichlorothiophen-3-YL)-2-Propen-1-One. J Struct Chem 59, 1440–1445 (2018). https://doi.org/10.1134/S0022476618060276

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  • DOI: https://doi.org/10.1134/S0022476618060276

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