Information card for entry 2211189

Structure parameters

• Chemical name: trans-Aquabis(glyoximato-κ^2^N,N')nitrocobalt(III)
• Formula: C4 H8 Co N5 O7
• Calculated formula: C4 H8 Co N5 O7
• SMILES: C1C=N([Co]2([N]=1O)(N(=O)=O)(N(=CC=[N]2O)=O)[OH2])=O
• Title of publication: <i>trans</i>-Aquabis(glyoximato-κ^2^<i>N</i>,<i>N</i>')nitrocobalt(III)
• Authors of publication: Rubin-Preminger, Janice M.; Englert, Ulli
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 11
• Pages of publication: m2972 - m2973
• a: 8.4127 ± 0.0018 Å
• b: 11.366 ± 0.002 Å
• c: 9.859 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 942.7 ± 0.3 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0439
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0846
• Weighted residual factors for all reflections included in the refinement: 0.0887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes