Information card for entry 4316513

Structure parameters

• Chemical name: bis(2,4-Pentanedionato)-bis(ethanol -O)-cobalt(ii)
• Formula: C14 H26 Co O6
• Calculated formula: C14 H26 Co O6
• SMILES: CC1=[O][Co]2(OC(=C1)C)([OH]CC)(OC(=CC(=[O]2)C)C)[OH]CC
• Title of publication: Monomeric Square-Planar Cobalt(II) Acetylacetonate: Mystery or Mistake?
• Authors of publication: Volodimir D. Vreshch; Jen-Hsien Yang; Haitao Zhang; Alexander S. Filatov; Evgeny V. Dikarev
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 8430 - 8434
• a: 5.312 ± 0.003 Å
• b: 8.875 ± 0.005 Å
• c: 9.479 ± 0.005 Å
• α: 74.439 ± 0.009°
• β: 81.489 ± 0.011°
• γ: 76.869 ± 0.01°
• Cell volume: 417.4 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.0956
• Weighted residual factors for all reflections included in the refinement: 0.1015
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No