Information card for entry 7240490

Structure parameters

• Chemical name: Sodium scandium oxalate hexahydrate
• Formula: C6 H10 Na3 O18 Sc
• Calculated formula: C6 H10 Na3 O18 Sc
• Title of publication: Solvent-free ageing reactions of rare earth element oxides: from geomimetic synthesis of new metal‒organic materials towards a simple, environmentally friendly separation of scandium
• Authors of publication: Huskić, Igor; Arhangelskis, Mihails; Friščić, Tomislav
• Journal of publication: Green Chemistry
• Year of publication: 2020
• Journal volume: 22
• Journal issue: 13
• Pages of publication: 4364 - 4375
• a: 17.851 ± 0.002 Å
• b: 11.0413 ± 0.0007 Å
• c: 18.2806 ± 0.0013 Å
• α: 90°
• β: 104.189 ± 0.002°
• γ: 90°
• Cell volume: 3493.2 ± 0.5 ų
• Cell temperature: 253 ± 2 K
• Ambient diffraction temperature: 253 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0596
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0829
• Weighted residual factors for all reflections included in the refinement: 0.0915
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No