Crystal structure and Hirshfeld surface analysis of dimethyl 2-oxo-4-(pyridin-2-yl)-6-(thiophen-2-yl)cyclohex-3-ene-1,3-dicarboxylate

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Naghiyev F. N., Khrustalev V. N., AKKURT M., Huseynov E. Z., Bhattarai A., Khalilov A. N., ...Daha Fazla

Acta Crystallographica Section E: Crystallographic Communications, cilt.80, sa.Pt 6, ss.654-658, 2024 (ESCI) identifier identifier

  • Yayın Türü: Makale / Tam Makale
  • Cilt numarası: 80 Sayı: Pt 6
  • Basım Tarihi: 2024
  • Doi Numarası: 10.1107/s2056989024004687
  • Dergi Adı: Acta Crystallographica Section E: Crystallographic Communications
  • Derginin Tarandığı İndeksler: Emerging Sources Citation Index (ESCI), Scopus
  • Sayfa Sayıları: ss.654-658
  • Anahtar Kelimeler: crystal structure, cyclohexene ring, Hirshfeld surface analysis, pyridine ring, thiophene ring
  • Erciyes Üniversitesi Adresli: Evet

Özet

In the title compound, C19H17NO5S, the cyclohexene ring adopts nearly an envelope conformation. In the crystal, molecules are linked by C - H⋯O hydrogen bonds, forming a three-dimensional network. In addition, C - H⋯π interactions connect the molecules by forming layers parallel to the (010) plane. According to the Hirshfeld surface analysis, H⋯H (36.9%), O⋯H/H⋯O (31.0%), C⋯H/H⋯C (18.9%) and S⋯H/H⋯S (7.9%) interactions are the most significant contributors to the crystal packing.