Information card for entry 7216115

Structure parameters

• Common name: (Co(H2O)5(bpdo))SO4 . 2H2O
• Chemical name: [Co(H2O)5(bpdo)]SO4 . 2H2O
• Formula: C10 H22 Co N2 O13 S
• Calculated formula: C10 H22 Co N2 O13 S
• SMILES: [Co]([OH2])([OH2])([OH2])([OH2])([OH2])[O]=n1ccc(cc1)c1ccn(=O)cc1.S(=O)(=O)([O-])[O-].O.O
• Title of publication: Anion dependent structural diversity in cobalt(ii) complexes of 4,4′-bipyridine-N,N′-dioxide
• Authors of publication: Bourne, Susan A.; Moitsheki, Lesego J.
• Journal of publication: CrystEngComm
• Year of publication: 2005
• Journal volume: 7
• Journal issue: 112
• Pages of publication: 674
• a: 7.122 ± 0.001 Å
• b: 25.319 ± 0.005 Å
• c: 10.241 ± 0.002 Å
• α: 90°
• β: 93.14 ± 0.03°
• γ: 90°
• Cell volume: 1843.9 ± 0.6 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 6
• 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: 0.0487
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.0882
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No