Information card for entry 2204952

Structure parameters

• Chemical name: Bis(pyridinium) tetrabromocadmate(II) monohydrate
• Formula: C10 H14 Br4 Cd N2 O
• Calculated formula: C10 H14 Br4 Cd N2 O
• SMILES: c1cccc[nH+]1.c1cccc[nH+]1.O.Br[Cd](Br)([Br-])[Br-]
• Title of publication: Bis(pyridinium) tetrabromocadmate(II) monohydrate
• Authors of publication: Zhang, Hui; Fang, Liang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 1
• Pages of publication: m101 - m102
• a: 14.951 ± 0.002 Å
• b: 9.1564 ± 0.0015 Å
• c: 12.815 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1754.3 ± 0.5 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0461
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0698
• Weighted residual factors for all reflections included in the refinement: 0.0767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes