Information card for entry 2219003

Structure parameters

• Chemical name: 2,2'-Bis(9-hydroxy-9-fluorenyl)biphenyl‒ethyl acetate (1/1)
• Formula: C42 H34 O4
• Calculated formula: C42 H34 O4
• SMILES: OC1(c2ccccc2c2ccccc12)c1ccccc1c1ccccc1C1(O)c2ccccc2c2ccccc12.CC(=O)OCC
• Title of publication: 2,2'-Bis(9-hydroxy-9-fluorenyl)biphenyl‒ethyl acetate (1/1)
• Authors of publication: Izotova, Lidiya; Ashurov, Jamshid; Ibragimov, Bakhtiyar; Weber, Edwin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 8
• Pages of publication: o1627
• a: 11.645 ± 0.002 Å
• b: 16.364 ± 0.003 Å
• c: 17.471 ± 0.003 Å
• α: 90°
• β: 97.72 ± 0.03°
• γ: 90°
• Cell volume: 3299.1 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1201
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.1174
• Weighted residual factors for all reflections included in the refinement: 0.1412
• Goodness-of-fit parameter for all reflections included in the refinement: 1.196
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes