Information card for entry 7103583

Structure parameters

• Common name: aqua(1,1'-di(propionic acid)-2,2;-biimidazole)cadium(ii) dihydrate
• Chemical name: aqua(1,1'-di(propionic acid)-2,2;-biimidazole)cadium(II) dihydrate
• Formula: C12 H18 Cd N4 O7
• Calculated formula: C12 H17 Cd N4 O7.001
• Title of publication: Unprecedented helix-based microporous metal-organic frameworks constructed from a single ligand.
• Authors of publication: Sang, Rui-Li; Xu, Li
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 46
• Pages of publication: 6143 - 6145
• a: 27.1286 ± 0.0011 Å
• b: 27.1286 ± 0.0011 Å
• c: 12.0736 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7695.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0553
• Residual factor for significantly intense reflections: 0.0548
• Weighted residual factors for significantly intense reflections: 0.1468
• Weighted residual factors for all reflections included in the refinement: 0.147
• Goodness-of-fit parameter for all reflections included in the refinement: 1.306
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No