Information card for entry 1504365

Structure parameters

• Formula: C49 H34 N2 O
• Calculated formula: C49 H34 N2 O
• SMILES: c1ccc(cc1)N(c1ccccc1)c1ccc(cc1)c1cc2c(cc1)c1c(C2=O)cc(cc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1
• Title of publication: Aggregation-Induced Emissions of Fluorenonearylamine Derivatives: A New Kind of Materials for Nondoped Red Organic Light-Emitting Diodes
• Authors of publication: Liu, Y.; Tao, X.; Wang, F.; Dang, X.; Zou, D.; Ren, Y.; Jiang, M.
• Journal of publication: Journal of Physical Chemistry C
• Year of publication: 2008
• Journal volume: 112
• Journal issue: 10
• Pages of publication: 3975
• a: 15.8751 ± 0.0008 Å
• b: 12.3295 ± 0.0007 Å
• c: 42.907 ± 0.002 Å
• α: 90°
• β: 93.705 ± 0.002°
• γ: 90°
• Cell volume: 8380.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2816
• Residual factor for significantly intense reflections: 0.1602
• Weighted residual factors for significantly intense reflections: 0.4234
• Weighted residual factors for all reflections included in the refinement: 0.4811
• Goodness-of-fit parameter for all reflections included in the refinement: 1.366
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No