Information card for entry 2205352

Structure parameters

• Chemical name: catena-Poly[[diaquacadmium(II)]-μ-benzene-1,4-dioxyacetato-κ^4^O,O':O'',O''']
• Formula: C10 H12 Cd O8
• Calculated formula: C10 H12 Cd O8
• SMILES: [Cd]12([OH2])([OH2])([O]=C(O1)COc1ccc(OCC(=O)[O-])cc1)[O]=C(O2)COc1ccc(cc1)OCC(=[O]1)O[Cd]1([OH2])[OH2]
• Title of publication: <i>catena</i>-Poly[[diaquacadmium(II)]-μ-benzene-1,4-dioxyacetato-κ^4^<i>O,O</i>':<i>O</i>'',<i>O</i>''']
• Authors of publication: Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua; Zhao, Hui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 3
• Pages of publication: m451 - m453
• a: 11.751 ± 0.0014 Å
• b: 5.51 ± 0.0011 Å
• c: 18.277 ± 0.0017 Å
• α: 90°
• β: 96.14 ± 0.02°
• γ: 90°
• Cell volume: 1176.6 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0529
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.1279
• Weighted residual factors for all reflections included in the refinement: 0.1502
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes