Information card for entry 1513275

Structure parameters

• Formula: C21 H23 B F2 N2
• Calculated formula: C21 H23 B F2 N2
• SMILES: [B]1(F)(F)[n]2c(C)cc(C)c2=C(c2n1c(C)cc2C)c1c(cccc1C)C
• Title of publication: Color Tuning of Polyfluorene Emission with BODIPY Monomers
• Authors of publication: Meng, Ge; Velayudham, Singaravelu; Smith, Adrian; Luck, Rudy; Liu, Haiying
• Journal of publication: Macromolecules
• Year of publication: 2009
• Journal volume: 42
• Journal issue: 6
• Pages of publication: 1995
• a: 20.442 ± 0.005 Å
• b: 7.847 ± 0.002 Å
• c: 25.831 ± 0.008 Å
• α: 90°
• β: 112.49 ± 0.02°
• γ: 90°
• Cell volume: 3828.4 ± 1.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.067
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.1806
• Weighted residual factors for all reflections included in the refinement: 0.1899
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No