Information card for entry 1574915

Structure parameters

• Formula: C17 H4 F8 N2
• Calculated formula: C17 H4 F8 N2
• Title of publication: Perfluoroarene-arene interaction cocrystal of perfluorocarbazoles toward IEF-enhanced photocatalysis.
• Authors of publication: Hu, Wenbo; Li, Heng; Yuan, Bingxin
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 30
• Pages of publication: 13794 - 13806
• a: 8.7918 ± 0.0009 Å
• b: 9.1879 ± 0.0011 Å
• c: 10.5298 ± 0.001 Å
• α: 72.342 ± 0.009°
• β: 70.631 ± 0.009°
• γ: 67.564 ± 0.01°
• Cell volume: 726.3 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0632
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1336
• Weighted residual factors for all reflections included in the refinement: 0.1522
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No