Information card for entry 2234068

Structure parameters

• Common name: tris(3-nitro-acetylacetonato)cobalt(III)
• Chemical name: Tris(3-nitropentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III)
• Formula: C15 H18 Co N3 O12
• Calculated formula: C15 H18 Co N3 O12
• Title of publication: Tris(3-nitropentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III)
• Authors of publication: Johnston, Dean H.; Brangham, Jack T.; Rapp, Christopher D.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: m312 - m313
• a: 32.7078 ± 0.0018 Å
• b: 32.7078 ± 0.0018 Å
• c: 7.4976 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8020.9 ± 0.9 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 110
• Hermann-Mauguin space group symbol: I 41 c d
• Hall space group symbol: I 4bw -2c
• Residual factor for all reflections: 0.0292
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0599
• Weighted residual factors for all reflections included in the refinement: 0.0613
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes