Information card for entry 7202133

Structure parameters

• Common name: bromoiodomethane
• Chemical name: bromoiodomethane
• Formula: C H2 Br I
• Calculated formula: C H2 Br I
• Title of publication: Isostructural relations in dihalomethanes and disproportionation of bromoiodomethane
• Authors of publication: Podsiadło, Marcin; Katrusiak, Andrzej
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 10
• Pages of publication: 1436
• a: 12.817 ± 0.003 Å
• b: 4.5223 ± 0.0009 Å
• c: 15.757 ± 0.003 Å
• α: 90°
• β: 114.45 ± 0.03°
• γ: 90°
• Cell volume: 831.4 ± 0.4 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 295 ± 2 K
• Ambient diffracton pressure: 100 kPa
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0646
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No