Information card for entry 2222705

Structure parameters

• Chemical name: 9-Benzyl-3-bromo-9<i>H</i>-carbazole
• Formula: C19 H14 Br N
• Calculated formula: C19 H14 Br N
• SMILES: Brc1ccc2n(c3ccccc3c2c1)Cc1ccccc1
• Title of publication: 9-Benzyl-3-bromo-9<i>H</i>-carbazole
• Authors of publication: Huang, Peng-Mian; Wang, Xiao-Chun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 8
• Pages of publication: o1763
• a: 17.629 ± 0.003 Å
• b: 14.666 ± 0.002 Å
• c: 5.642 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1458.7 ± 0.4 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.069
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes