Information card for entry 7031826

Structure parameters

• Formula: C7 H18 Co2 N3 O12 S
• Calculated formula: C7 H18 Co2 N3 O12 S
• Title of publication: New open-framework cobalt sulfate-oxalates based on molecular and chain-like building blocks.
• Authors of publication: Wang, Kangcai; Luo, Daibing; Xu, Dingguo; Guo, Furong; Liu, Lin; Lin, Zhien
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 36
• Pages of publication: 13476 - 13479
• a: 8.6065 ± 0.0003 Å
• b: 9.5595 ± 0.0005 Å
• c: 9.5987 ± 0.0005 Å
• α: 77.884 ± 0.004°
• β: 82.744 ± 0.004°
• γ: 87.356 ± 0.004°
• Cell volume: 765.79 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0327
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.0606
• Weighted residual factors for all reflections included in the refinement: 0.0638
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No