Information card for entry 2206764

Structure parameters

• Chemical name: catena-Poly[[aquadipyridinezinc(II)]-μ-benzene-1,4-dioxyacetato]
• Formula: C20 H20 N2 O7 Zn
• Calculated formula: C20 H20 N2 O7 Zn
• SMILES: [Zn]([OH2])([n]1ccccc1)([n]1ccccc1)OC(=O)COc1ccc(cc1)OCC(=O)O[Zn]([OH2])([n]1ccccc1)([n]1ccccc1)OC(=O)COc1ccc(cc1)OCC(=O)[O-]
• Title of publication: <i>catena</i>-Poly[[aquadipyridinezinc(II)]-μ-benzene-1,4-dioxyacetato]
• Authors of publication: Hong, Xian-Lan; Li, Yi-Zhi; Bai, Jun-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 9
• Pages of publication: m1863 - m1865
• a: 15.579 ± 0.003 Å
• b: 6.0883 ± 0.0012 Å
• c: 21.725 ± 0.004 Å
• α: 90°
• β: 104.76 ± 0.03°
• γ: 90°
• Cell volume: 1992.6 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0658
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.0886
• Goodness-of-fit parameter for all reflections included in the refinement: 0.876
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No