Information card for entry 2231528

Structure parameters

• Chemical name: Bis(2-bromo-5-methylphenoxy)methane
• Formula: C15 H14 Br2 O2
• Calculated formula: C15 H14 Br2 O2
• Title of publication: Bis(2-bromo-5-methylphenoxy)methane
• Authors of publication: Niu, Jun-long; Wang, Xia; Zhang, Lin-bao; Song, Mao-ping
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: o2539
• a: 10.7752 ± 0.0011 Å
• b: 15.869 ± 0.0017 Å
• c: 4.3272 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 739.9 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.072
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1048
• Weighted residual factors for all reflections included in the refinement: 0.1232
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes