Information card for entry 2235752

Structure parameters

• Chemical name: Bis[2-(2-hydroxymethyl)pyridine-κ^2^<i>N</i>,<i>O</i>](pivalato- κ<i>O</i>)copper(II)
• Formula: C22 H32 Cu N2 O6
• Calculated formula: C22 H32 Cu N2 O6
• SMILES: [Cu]12([n]3ccccc3C[OH]1)([n]1ccccc1C[OH]2)(OC(=O)C(C)(C)C)OC(=O)C(C)(C)C
• Title of publication: Bis[2-(2-hydroxymethyl)pyridine-κ^2^<i>N</i>,<i>O</i>](pivalato-κ<i>O</i>)copper(II)
• Authors of publication: Shaikh, M. Mobin; Mishra, Veenu; Ram, Priti; Birla, Anil
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 8
• Pages of publication: m1055
• a: 9.797 ± 0.005 Å
• b: 8.829 ± 0.005 Å
• c: 13.674 ± 0.005 Å
• α: 90°
• β: 91.907 ± 0.005°
• γ: 90°
• Cell volume: 1182.1 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0438
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.1135
• Weighted residual factors for all reflections included in the refinement: 0.1189
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes