Crystal structure and Hirshfeld surface analysis of (3aRS,4RS,10SR,10aSR)-2-(3,5-dimethylphenyl)-4-hydroxy-10-methyl-1-oxo-2,3,3a,4,10,10ahexahydro-1H-[1]benzofuro[2,3-f]isoindole-10-carboxylic acid dimethylformamide monosolvate

The molecular conformation of the title compound, C24H23NO5·C3H7NO, is consolidated by intramolecular C—H· · ·O O—H· · ·O hydrogen bonds, forming an S(6) ring motif. In the crystal, the molecules are connected by C—H· · ·O hydrogen bonds, forming layers parallel to the (101) plane. Furthermore, the molecules form layers parallel to the (102) plane by C—H· · ·π interactions. Important intermolecular interactions highlighted by Hirshfeld surface analysis are H· · ·H (54.7%), O· · ·H/H· · ·O (23.0%), and C· · ·H/H· · ·C (19.9%) contacts. © 2025 International Union of Crystallography. All rights reserved.

Авторы
Yakovleva Elizaveta D. 1 , Salakhova Victoria I. 1 , Khrustalev Victor N. 1, 2 , Nazarova Roya Z. 3 , Hasanov Khudayar I. 4 , Javadzade Tahir A. 5 , Akkurt Mehmet 6 , Manahelohe Gizachew Mulugeta 7
Издательство
International Union of Crystallography
Номер выпуска
Pt 9
Язык
English
Страницы
816-820
Статус
Published
Том
81
Год
2025
Организации
  • 1 RUDN University, Moscow, Moscow Oblast, Russian Federation
  • 2 N.D. Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russian Federation
  • 3 Baku Engineering University, Absheron, Azerbaijan
  • 4 Azerbaijan Medical University, Baku, Azerbaijan
  • 5 Department of Chemistry and Chemical Engineering, Khazar University, Baku, Azerbaijan
  • 6 Department of Physics, Erciyes Üniversitesi, Kayseri, Kayseri, Turkey
  • 7 Department of Chemistry, University of Gondar, Gondar, Amhara, Ethiopia
Ключевые слова
crystal structure; envelope conformation; Hirshfeld surface analysis; hydrogen bonds
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Другие записи

Yakovleva Elizaveta D., Salakhova Victoria I., Khrustalev Victor N., Nazarova Roya Z., Hasanov Khudayar I., Javadzade Tahir A., Akkurt Mehmet, Manahelohe Gizachew Mulugeta
Acta Crystallographica Section E: Crystallographic Communications. Том 81. 2025. С. 816-820