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article · Acta Crystallographica Section E Crystallographic Communications

Crystal structure and Hirshfeld surface analysis of 6-bromo-2-(pentafluorophenyl)-2,3,7,7a-tetrahydro-3a,6-epoxyisoindol-1(6 H )-one

2026Open accessGondar University

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Abstract

In the crystal, enantiomeric molecules of C 14 H 7 BrF 5 NO 2 are linked by C—H...O hydrogen bonds, forming layers parallel to the ( 1 01) plane. In addition, C—H...π interactions and Br...π contacts create layers parallel to the (10 1 ) plane. According to Hirshfeld surface analysis, the most important contributions to the crystal packing are F...H / H...F (32.4%), O...H / H...O (12.4%), F...F (11.5%), Br...F / F...Br (8.4%) and C...H / H...C (8.4%) interactions.

Research topics

  • Synthesis and pharmacology of benzodiazepine derivatives
  • Crystal structures of chemical compounds
  • Beetle Biology and Toxicology Studies

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DOI: 10.1107/s2056989026008108

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