Information card for entry 2210939

Structure parameters

• Chemical name: 1,2,4,5-tetrakis(bromomethyl)benzene
• Formula: C10 H10 Br4
• Calculated formula: C10 H10 Br4
• SMILES: BrCc1cc(CBr)c(cc1CBr)CBr
• Title of publication: 1,2,4,5-Tetrakis(bromomethyl)benzene
• Authors of publication: Wang, Zhi-Guo; Wang, Yu-Zhou; She, Neng-Fang; Gao, Meng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 11
• Pages of publication: o5106 - o5107
• a: 6.9695 ± 0.0014 Å
• b: 9.88 ± 0.002 Å
• c: 9.2352 ± 0.0019 Å
• α: 90°
• β: 103.638 ± 0.004°
• γ: 90°
• Cell volume: 618 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• 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: 0.0506
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0916
• Weighted residual factors for all reflections included in the refinement: 0.0974
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes