Information card for entry 2207269

Structure parameters

• Chemical name: Bis(dimethylammonium) aquadioxalatocuprate(II) monohydrate
• Formula: C8 H20 Cu N2 O10
• Calculated formula: C8 H20 Cu N2 O10
• SMILES: [Cu]12(OC(=O)C(=O)O1)(OC(=O)C(=O)O2)[OH2].[NH2+](C)C.[NH2+](C)C.O
• Title of publication: Bis(dimethylammonium) aquadioxalatocuprate(II) monohydrate
• Authors of publication: Xin-Hua Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: m2327 - m2328
• a: 11.76 ± 0.0016 Å
• b: 9.5328 ± 0.0013 Å
• c: 15.3997 ± 0.0016 Å
• α: 90°
• β: 118.103 ± 0.008°
• γ: 90°
• Cell volume: 1522.9 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.028
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0716
• Weighted residual factors for all reflections included in the refinement: 0.0734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes