Information card for entry 2230924

Structure parameters

• Chemical name: 1,8-Bis(4-fluorophenyl)naphthalene
• Formula: C22 H14 F2
• Calculated formula: C22 H14 F2
• SMILES: Fc1ccc(cc1)c1cccc2c1c(ccc2)c1ccc(F)cc1
• Title of publication: 1,8-Bis(4-fluorophenyl)naphthalene
• Authors of publication: Feng, Jin-Wu; Han, Qing-Chuan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 7
• Pages of publication: o1595
• a: 8.4086 ± 0.0011 Å
• b: 9.6252 ± 0.0011 Å
• c: 11.2618 ± 0.0013 Å
• α: 87.705 ± 0.009°
• β: 74.895 ± 0.01°
• γ: 64.111 ± 0.012°
• Cell volume: 788.81 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0861
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.086
• Weighted residual factors for all reflections included in the refinement: 0.0949
• Goodness-of-fit parameter for all reflections included in the refinement: 0.831
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes