Information card for entry 7116713

Structure parameters

• Chemical name: Na-Cr-OA
• Formula: C6 H6 Fe Na3 O17
• Calculated formula: C6 H6 Fe Na3 O17
• SMILES: C1(=O)C(=O)O[Fe]23(OC(=O)C(=O)O3)(OC(=O)C(=O)O2)O1.[Na+].O.O.[Na+].O.O.[Na+].O
• Title of publication: Oxalic acid complexes: promising draw solutes for forward osmosis (FO) in protein enrichment
• Authors of publication: Qingchun Ge; Tai-Shung Chung
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 4854
• a: 17.4212 ± 0.0009 Å
• b: 12.5545 ± 0.0007 Å
• c: 14.9217 ± 0.0008 Å
• α: 90°
• β: 101.047 ± 0.002°
• γ: 90°
• Cell volume: 3203.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0373
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.1137
• Weighted residual factors for all reflections included in the refinement: 0.1144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.188
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No