Information card for entry 1543228

Structure parameters

• Chemical name: 1,3,6-Tribromo-9-ethyl-9<i>H</i>-carbazole
• Formula: C14 H10 Br3 N
• Calculated formula: C14 H10 Br3 N
• SMILES: Brc1c2n(c3c(c2cc(Br)c1)cc(Br)cc3)CC
• Title of publication: 1,3,6-Tribromo-9-ethyl-9<i>H</i>-carbazole
• Authors of publication: Bezuglyi, Mkola; Bagdziunas, Gintautas; Grazulevicius, Juozas Vidas
• Journal of publication: IUCrData
• Year of publication: 2016
• Journal volume: 1
• Journal issue: 4
• Pages of publication: x160708
• a: 17.17 ± 0.06 Å
• b: 4.267 ± 0.013 Å
• c: 20.22 ± 0.06 Å
• α: 90°
• β: 108.45 ± 0.04°
• γ: 90°
• Cell volume: 1405 ± 8 ų
• Cell temperature: 273 K
• Ambient diffraction temperature: 273 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 significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.2493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes