Information card for entry 8102784

Structure parameters

• Formula: C17 H30 Cd2 N4 O15
• Calculated formula: C17 H30 Cd2 N4 O15
• Title of publication: Crystal structure of catena-aquabis(pyridine-2,6-dicarboxylato-O,N,O')-(1,2-propylenediamine)dicadmium(II) hexahydrate, Cd2(H2O)(C7H3NO4)2(C3H10N2) · 6H2O
• Authors of publication: Ya-Zhou Xu; Wei-Ping Tang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 3
• Pages of publication: 597
• a: 11.5769 ± 0.0014 Å
• b: 9.9113 ± 0.0012 Å
• c: 12.2931 ± 0.0015 Å
• α: 90°
• β: 111.048 ± 0.001°
• γ: 90°
• Cell volume: 1316.4 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0276
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for significantly intense reflections: 0.057
• Weighted residual factors for all reflections included in the refinement: 0.0597
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No