Information card for entry 2200658

Structure parameters

• Chemical name: Phenyl 2,4,6-tribromophenyl ether
• Formula: C12 H7 Br3 O
• Calculated formula: C12 H7 Br3 O
• SMILES: Brc1c(Oc2ccccc2)c(Br)cc(Br)c1
• Title of publication: Phenyl 2,4,6-tribromophenyl ether
• Authors of publication: Eriksson, Lars; Hu, Jiwei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 10
• Pages of publication: o930 - o932
• a: 5.994 ± 0.002 Å
• b: 10.182 ± 0.005 Å
• c: 11.479 ± 0.005 Å
• α: 109.43 ± 0.05°
• β: 99.76 ± 0.04°
• γ: 97.37 ± 0.05°
• Cell volume: 638.1 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0565
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for all reflections included in the refinement: 0.0655
• Goodness-of-fit parameter for all reflections included in the refinement: 1.23
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes