Crystal structure and Hirshfeld surface analysis of (Z)-4-({[2-(benzo[b]thiophen-3-yl)cyclopent-1-en-1-yl]methyl}(phenyl)amino)-4-oxobut-2-enoic acid

In the title compound, C24H21NO3S, the cyclopentene ring adopts an envelope conformation. In the crystal, molecules are linked by C—H...π interactions, forming ribbons along the a axis. Intermolecular C—H...O hydrogen bonds connect these ribbons to each other, forming layers parallel to the (0\overline{1}1) plane. The molecular packing is strengthened by van der Waals interactions between the layers. The intermolecular contacts were quantified using Hirshfeld surface analysis and two-dimensional fingerprint plots, revealing the relative contributions of the contacts to the crystal packing to be H...H 46.0%, C...H/H...C 21.1%, O...H/H...O 20.6% and S...H/H...S 9.0%.

Авторы
Yakovleva E.D. 1 , Shelukho E.R. 1 , Grigoriev M.S. 2 , Hasanov K.I. 3, 4 , Sadikhova N.D. 5 , Akkurt Mehmet 6 , Bhattarai Ajaya 7
Издательство
International Union of Crystallography
Номер выпуска
5
Язык
Unknown
Страницы
537-542
Статус
Published
Том
80
Год
2024
Организации
  • 1 RUDN University, 6 Miklukho-Maklaya St., Moscow 117198, Russian Federation.
  • 2 Frumkin Institute of Physical Chemistry and Electrochemistry, Russian Academy of Sciences, Leninskiy prospect 31-4, Moscow 119071, Russian Federation.
  • 3 Azerbaijan Medical University, Scientific Research Centre (SRC), A. Kasumzade St. 14, AZ 1022, Baku, Azerbaijan.
  • 4 Western Caspian University, Istiqlaliyyat Street 31, AZ 1001, Baku, Azerbaijan.
  • 5 Department of Chemistry, Baku State University, Z. Xalilov Str. 23, AZ 1148 Baku, Azerbaijan.
  • 6 Department of Physics, Faculty of Sciences, Erciyes University, 38039 Kayseri, Türkiye.
  • 7 Department of Chemistry, M.M.A.M.C. (Tribhuvan University), Biratnagar, Nepal.
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