Information card for entry 2202847

Structure parameters

• Formula: C15 H21 Co Na O6
• Calculated formula: C15 H21 Co Na O6
• SMILES: CC1=CC(C)=[O][Co]23(O1)([O]=C(C)C=C(C)O2)OC(=CC(C)=[O]3)C.[Na+]
• Title of publication: Sodium tris(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)
• Authors of publication: Li, Xiaobao; Musie, Ghezai; Powell, Douglas R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 9
• Pages of publication: m717 - m718
• a: 16.1201 ± 0.0019 Å
• b: 16.1201 ± 0.0019 Å
• c: 11.715 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2636.4 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0675
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0918
• Weighted residual factors for all reflections included in the refinement: 0.1194
• Goodness-of-fit parameter for all reflections included in the refinement: 1.245
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No