Information card for entry 2012083

Structure parameters

• Chemical name: Potassium bis(carbonato-O,O')(ethylenediamine-N,N')cobaltate(III) monohydrate
• Formula: C4 H10 Co K N2 O7
• Calculated formula: C4 H10 Co K N2 O7
• SMILES: [K+].O=C1O[Co]23([NH2]CC[NH2]3)(O1)OC(=O)O2.O
• Title of publication: Potassium bis(carbonato-<i>O</i>,<i>O</i>')(ethylenediamine-<i>N</i>,<i>N</i>')cobaltate(III) monohydrate at 173K
• Authors of publication: Belai, Nebebech; Dickman, Michael H.; Pope, Michael T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 7
• Pages of publication: 802 - 803
• a: 8.2527 ± 0.0013 Å
• b: 7.3864 ± 0.0012 Å
• c: 8.5085 ± 0.0014 Å
• α: 90°
• β: 108.947 ± 0.002°
• γ: 90°
• Cell volume: 490.56 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0221
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for all reflections included in the refinement: 0.0573
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No