Information card for entry 2013542

Structure parameters

• Formula: C12 H12 Cl2 Cu N4 O6
• Calculated formula: C12 H12 Cl2 Cu N4 O6
• SMILES: [Cu]12(ON(=O)=[O]1)([n]1c(ccc(c1)C)Cl)([n]1c(ccc(c1)C)Cl)ON(=O)=[O]2
• Title of publication: Bis(2-chloro-5-methylpyridine-κ<i>N</i>)bis(nitrato-κ^2^<i>O</i>,<i>O</i>')copper(II)
• Authors of publication: Xuan, Richeng; Li, Meichao; Wan, Yuehua
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: m462 - m464
• a: 6.6855 ± 0.0002 Å
• b: 13.2221 ± 0.0003 Å
• c: 9.9254 ± 0.0003 Å
• α: 90°
• β: 102.543 ± 0.0008°
• γ: 90°
• Cell volume: 856.43 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for all reflections included in the refinement: 0.072
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes