Information card for entry 7222105

Structure parameters

• Formula: C6 H26 Co N4 Na O9 S2
• Calculated formula: C6 H26 Co N4 Na O9 S2
• SMILES: [Co]12(S(=O)(=O)[O-])([NH2]CCC[NH2]1)(S(=O)(=O)[O-])[NH2]CCC[NH2]2.[Na+].O.O.O
• Title of publication: H‒bond Supported Coordination Polymers of Transition Metal Sulfites with Different Dimensionalities
• Authors of publication: Behera, Jogendra Nath; Kumar, Jitendra; Tiwari, Ranjay K.
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 8.7984 ± 0.0002 Å
• b: 13.7933 ± 0.0002 Å
• c: 13.9548 ± 0.0002 Å
• α: 90°
• β: 103.557 ± 0.001°
• γ: 90°
• Cell volume: 1646.35 ± 0.05 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0422
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0775
• Weighted residual factors for all reflections included in the refinement: 0.0821
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No