Information card for entry 2212573

Structure parameters

• Chemical name: 9-(4-Fluorobenzyl)-9H-carbazole
• Formula: C19 H14 F N
• Calculated formula: C19 H14 F N
• SMILES: Fc1ccc(Cn2c3ccccc3c3ccccc23)cc1
• Title of publication: 9-(4-Fluorobenzyl)-9<i>H</i>-carbazole
• Authors of publication: Huang, Peng-Mian; Duan, Xue-Min; Yang, Dao-Wu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 3
• Pages of publication: o1264 - o1265
• a: 11.225 ± 0.003 Å
• b: 11.794 ± 0.003 Å
• c: 10.981 ± 0.003 Å
• α: 90°
• β: 99.189 ± 0.005°
• γ: 90°
• Cell volume: 1435.1 ± 0.7 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 4
• 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: 0.0414
• Weighted residual factors for significantly intense reflections: 0.0885
• Weighted residual factors for all reflections included in the refinement: 0.1161
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes