Information card for entry 7024050

Structure parameters

• Common name: 1D-Cadmium thiosulfate
• Formula: C60 H68 Cd2 N12 O20 S8
• Calculated formula: C60 H52 Cd2 N12 O20 S8
• Title of publication: Synthesis, structure, transformation studies and catalytic properties of open-framework cadmium thiosulfate compounds.
• Authors of publication: Paul, Avijit Kumar; Madras, Giridhar; Natarajan, Srinivasan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 9
• Pages of publication: 2263 - 2279
• a: 13.42 ± 0.003 Å
• b: 17.361 ± 0.004 Å
• c: 15.84 ± 0.003 Å
• α: 90°
• β: 105.228 ± 0.003°
• γ: 90°
• Cell volume: 3560.9 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.106
• Residual factor for significantly intense reflections: 0.0677
• Weighted residual factors for significantly intense reflections: 0.1585
• Weighted residual factors for all reflections included in the refinement: 0.1814
• 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