Information card for entry 2002995

Structure parameters

• Formula: C8 H18 Cd O11
• Calculated formula: C8 H14 Cd O11
• Title of publication: An Unusual Hydrogen-Bonded Network Associated with Metal-Organic Chains: Structure and Crystal Packing of the Coordination Polymer [Cd(terephthalate)(H~2~O)~3~].4H~2~O
• Authors of publication: Michaelides, O. A.; Tsaousis, D.; Skoulika, S.; Raptopoulou, C. P.; Terzis, A.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 5
• Pages of publication: 657 - 662
• a: 7.304 ± 0.003 Å
• b: 9.981 ± 0.003 Å
• c: 19.956 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1454.8 ± 0.9 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 54
• Hermann-Mauguin space group symbol: P c c a
• Hall space group symbol: -P 2a 2ac
• Residual factor for all reflections: 0.0303
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for all reflections: 0.0743
• Weighted residual factors for significantly intense reflections: 0.0716
• Goodness-of-fit parameter for all reflections: 1.119
• Goodness-of-fit parameter for significantly intense reflections: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes