Information card for entry 2210054

Structure parameters

• Chemical name: Bis(μ~2~-N-5-formysalicylideneglycinato-κ^4^O,N,O':O')bis[aquacopper(II)]
• Formula: C20 H18 Cu2 N2 O10
• Calculated formula: C20 H18 Cu2 N2 O10
• SMILES: [Cu]123([OH2])[N](CC(=O)O1)=Cc1cc(C=O)ccc1[O]2[Cu]12([OH2])[N](CC(=O)O1)=Cc1cc(C=O)ccc1[O]23
• Title of publication: Bis(μ~2~-<i>N</i>-5-formysalicylideneglycinato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>')bis[aquacopper(II)]
• Authors of publication: Jin-Hua Cai; Ying-Heng Huang; Yi-Min Jiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2064 - m2066
• a: 9.281 ± 0.016 Å
• b: 9.06 ± 0.015 Å
• c: 12.62 ± 0.02 Å
• α: 90°
• β: 104.495 ± 0.019°
• γ: 90°
• Cell volume: 1027 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0529
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1192
• Weighted residual factors for all reflections included in the refinement: 0.1247
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No