Information card for entry 2234848

Structure parameters

• Chemical name: <i>catena</i>-Poly[[aqua(2-iodobenzoato-κ<i>O</i>)cobalt(II)]- μ-aqua-μ-2-iodobenzoato-κ^2^<i>O</i>:<i>O</i>']
• Formula: C14 H12 Co I2 O6
• Calculated formula: C14 H12 Co I2 O6
• SMILES: [Co]1(OC(=O)c2c(I)cccc2)(OC(=O)c2c(I)cccc2)([OH2])([OH2])[O]=C(O[Co](OC(=O)c2c(I)cccc2)([OH2]1)[OH2])c1c(I)cccc1
• Title of publication: <i>catena</i>-Poly[[aqua(2-iodobenzoato-κ<i>O</i>)cobalt(II)]-μ-aqua-μ-2-iodobenzoato-κ^2^<i>O</i>:<i>O</i>']
• Authors of publication: Aydın, Ömür; Çaylak Delibaş, Nagihan; Necefoğlu, Hacali; Hökelek, Tuncer
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m601 - m602
• a: 7.5051 ± 0.0003 Å
• b: 10.5639 ± 0.0004 Å
• c: 21.6723 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1718.25 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0202
• Residual factor for significantly intense reflections: 0.0201
• Weighted residual factors for significantly intense reflections: 0.0509
• Weighted residual factors for all reflections included in the refinement: 0.051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.202
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes