Information card for entry 8107107

Structure parameters

• Formula: C12 H22 Cd N4 O14
• Calculated formula: C12 H22 Cd N4 O14
• Title of publication: Crystal structure of diaqua-bis(2-methyl-1H-imidazole-4,5-dicarboxylato-κ2-O,N)cadmium(II) tetrahydrate, C12H22CdN4O14
• Authors of publication: Xiong, Zhi-Qiang; Song, Xiu-Ying; Nie, Xu-Liang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 4
• Pages of publication: 1085 - 1086
• a: 7.188 ± 0.002 Å
• b: 8.895 ± 0.003 Å
• c: 9.771 ± 0.003 Å
• α: 63.148 ± 0.003°
• β: 76.75 ± 0.003°
• γ: 66.225 ± 0.003°
• Cell volume: 509.2 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0255
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0674
• Weighted residual factors for all reflections included in the refinement: 0.0676
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No