Information card for entry 2015421

Structure parameters

• Chemical name: 2,2',3,3',4,4',5,5',6,6'-Decafluorodiphenylamine‒diphenylamine (1/1)
• Formula: C24 H12 F10 N2
• Calculated formula: C24 H12 F10 N2
• Title of publication: 2,2',3,3',4,4',5,5',6,6'-Decafluorodiphenylamine and its 1:1 cocrystal with diphenylamine
• Authors of publication: Grzegorczyk, Monika; Gdaniec, Maria
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 7
• Pages of publication: o419 - o422
• a: 21.417 ± 0.003 Å
• b: 5.7778 ± 0.0011 Å
• c: 8.1895 ± 0.0014 Å
• α: 90°
• β: 94.312 ± 0.013°
• γ: 90°
• Cell volume: 1010.5 ± 0.3 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 4
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0502
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.1123
• Weighted residual factors for all reflections included in the refinement: 0.1143
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes