Information card for entry 2205727

Structure parameters

• Chemical name: catena-Poly[[aquazinc(II)]-μ-2-carboxylatophenoxyacetato]
• Formula: C9 H8 O6 Zn
• Calculated formula: C9 H8 O6 Zn
• SMILES: [Zn]12(OC(=O)c3ccccc3[O]1CC(=O)O2)([OH2])[O]=C1O[Zn]2([O](c3c1cccc3)CC(=O)O2)[OH2]
• Title of publication: <i>catena</i>-Poly[[aquazinc(II)]-μ-2-carboxylatophenoxyacetato]
• Authors of publication: Yang, Yan; Meng, Fa-Yan; Zeng, Ming-Hua; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 5
• Pages of publication: m986 - m988
• a: 8.157 ± 0.001 Å
• b: 6.7568 ± 0.0008 Å
• c: 17.451 ± 0.002 Å
• α: 90°
• β: 94.697 ± 0.002°
• γ: 90°
• Cell volume: 958.6 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.026
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for significantly intense reflections: 0.058
• Weighted residual factors for all reflections included in the refinement: 0.06
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes