Information card for entry 1574916

Structure parameters

• Formula: C27 H10 F8 N2
• Calculated formula: C27 H10 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: 9.9143 ± 0.001 Å
• b: 10.2042 ± 0.001 Å
• c: 11.3792 ± 0.0012 Å
• α: 80.453 ± 0.008°
• β: 70.664 ± 0.01°
• γ: 87.322 ± 0.008°
• Cell volume: 1071.2 ± 0.2 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: 0.084
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1577
• Weighted residual factors for all reflections included in the refinement: 0.189
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No