Information card for entry 2010742

Structure parameters

• Chemical name: 2,2'-(9,9-dihexyl)bifluorene
• Formula: C50 H66
• Calculated formula: C50 H66
• SMILES: CCCCCCC1(CCCCCC)c2cc(ccc2c2c1cccc2)c1ccc2c(c1)C(CCCCCC)(CCCCCC)c1c2cccc1
• Title of publication: 2,2'-Bi(9,9-dihexylfluorene)
• Authors of publication: Suchod, Bernadette; Stéphan, Olivier
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 3
• Pages of publication: e92 - e93
• a: 15.975 ± 0.002 Å
• b: 15.773 ± 0.002 Å
• c: 17.142 ± 0.002 Å
• α: 90°
• β: 100.51 ± 0.01°
• γ: 90°
• Cell volume: 4246.9 ± 0.9 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.158
• Residual factor for significantly intense reflections: 0.1
• Weighted residual factors for all reflections: 0.043
• Weighted residual factors for all reflections included in the refinement: 0.039
• Goodness-of-fit parameter for all reflections: 1.267
• Goodness-of-fit parameter for all reflections included in the refinement: 1.511
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No