Information card for entry 2239161

Structure parameters

• Chemical name: Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis[(pyridine-2-carbonitrile-κ<i>N</i>^1^)copper(II)]
• Formula: C20 H20 Cu2 N4 O8
• Calculated formula: C20 H20 Cu2 N4 O8
• SMILES: c1[n](c(ccc1)C#N)[Cu]1234[O]=C(C)O[Cu]4([n]4ccccc4C#N)([O]=C(C)O2)(OC(=[O]1)C)[O]=C(O3)C
• Title of publication: Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis[(pyridine-2-carbonitrile-κ<i>N</i>^1^)copper(II)]
• Authors of publication: Luo, Mei; Wang, Lei; Zhang, Jing-Cheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 1
• Pages of publication: m27
• a: 7.929 ± 0.005 Å
• b: 19.817 ± 0.012 Å
• c: 8.222 ± 0.005 Å
• α: 90°
• β: 118.83 ± 0.02°
• γ: 90°
• Cell volume: 1131.8 ± 1.2 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0697
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1512
• Weighted residual factors for all reflections included in the refinement: 0.1587
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes