Information card for entry 2208575

Structure parameters

• Chemical name: Bis[2-(dimethylamino)ethanol-κ^2^N,O](2,4-pentanedionate-κ^2^O,O')nickel(II) acetate
• Formula: C15 H32 N2 Ni O6
• Calculated formula: C15 H32 N2 Ni O6
• SMILES: C1C[N](C)(C)[Ni]23([N](CC[OH]2)(C)C)([OH]1)[O]=C(C)C=C(C)O3.C(=O)(C)[O-]
• Title of publication: Bis[2-(dimethylamino)ethanol-κ^2^<i>N</i>,<i>O</i>](2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')nickel(II) acetate
• Authors of publication: Muhammad, Sultan; Mazhar, Muhammad; Zeller, Matthias; Hunter, Allen D.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 4
• Pages of publication: m824 - m826
• a: 8.5456 ± 0.001 Å
• b: 12.5165 ± 0.0015 Å
• c: 18.109 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1937 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0247
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0626
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes