Information card for entry 2207970

Structure parameters

• Common name: 9-(4-Chloro-benzyl)-9H-carbazole
• Chemical name: 9-(4-Chloro-benzyl)-9H-carbazole
• Formula: C19 H14 Cl N
• Calculated formula: C19 H14 Cl N
• SMILES: Clc1ccc(Cn2c3ccccc3c3ccccc23)cc1
• Title of publication: 9-(4-Chlorobenzyl)-9<i>H</i>-carbazole
• Authors of publication: Cui, Jian-Lan; Huang, Peng-Mian; Guo, Wen-Long
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 2
• Pages of publication: o500 - o501
• a: 5.5571 ± 0.001 Å
• b: 13.675 ± 0.003 Å
• c: 19.357 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1471 ± 0.5 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0794
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0713
• Weighted residual factors for all reflections included in the refinement: 0.083
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No