Information card for entry 4344606

Structure parameters

• Formula: Br6 H8 N2 O32 Pb8
• Calculated formula: Br6 H2 N2 O32 Pb8
• Title of publication: Pb4(OH)4(BrO3)3(NO3): An Example of SHG Crystal in Metal Bromates Containing π-Conjugated Planar Triangle.
• Authors of publication: Kong, Fang; Hu, Chun-Li; Liang, Ming-Li; Mao, Jiang-Gao
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 2
• Pages of publication: 948 - 955
• a: 10.074 ± 0.002 Å
• b: 19.262 ± 0.005 Å
• c: 32.57 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6320 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0581
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1175
• Weighted residual factors for all reflections included in the refinement: 0.1252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No