Information card for entry 2221816

Structure parameters

• Chemical name: Bis[4-(dimethylamino)pyridinium] tetrabromidocadmate(II) monohydrate
• Formula: C14 H24 Br4 Cd N4 O
• Calculated formula: C14 H24 Br4 Cd N4 O
• SMILES: [Cd](Br)(Br)([Br-])[Br-].O.[nH+]1ccc(N(C)C)cc1.[nH+]1ccc(N(C)C)cc1
• Title of publication: Bis[4-(dimethylamino)pyridinium] tetrabromidocadmate(II) monohydrate
• Authors of publication: Lo, Kong Mun; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: m560
• a: 7.8918 ± 0.0002 Å
• b: 8.1197 ± 0.0002 Å
• c: 17.2719 ± 0.0004 Å
• α: 95.481 ± 0.001°
• β: 99.747 ± 0.001°
• γ: 96.489 ± 0.001°
• Cell volume: 1076.35 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0439
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.1168
• Weighted residual factors for all reflections included in the refinement: 0.1307
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes