Information card for entry 2205832

Structure parameters

• Formula: C4 H16 Cu N10 O2
• Calculated formula: C4 H16 Cu N10 O2
• SMILES: C1(=NC(=[NH][Cu]2(N1)NC(=NC(=[NH]2)N)N)N)N.O.O
• Title of publication: Bis(biguanido-κ^2^<i>N</i>,<i>N</i>')copper(II) dihydrate
• Authors of publication: Su, Ying-Lan; Lu, Li-Ping; Li, Xue-Mei; Zhu, Miao-Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 5
• Pages of publication: m910 - m912
• a: 7.133 ± 0.003 Å
• b: 22.536 ± 0.008 Å
• c: 7.056 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1134.2 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0465
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.195
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes