Information card for entry 2230440

Structure parameters

• Chemical name: Bis{μ-2-[(pyridin-2-yl)iminomethyl]phenolato}bis[(2- formylphenolato)copper(II)]
• Formula: C38 H28 Cu2 N4 O6
• Calculated formula: C38 H28 Cu2 N4 O6
• SMILES: [Cu]12([O]=Cc3c(O1)cccc3)[N](=Cc1c(O2)cccc1)c1cccc[n]1[Cu]12([N](=Cc3c(O1)cccc3)c1ncccc1)[O]=Cc1ccccc1O2
• Title of publication: Bis{μ-2-[(pyridin-2-yl)iminomethyl]phenolato}bis[(2-formylphenolato)copper(II)]
• Authors of publication: Chang, Hui-Chang; Cole, Jacqueline M.; Lin, Tze-Chia; Sylvester, Sven O.; Waddell, Paul G.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: m690
• a: 8.9811 ± 0.0018 Å
• b: 18.856 ± 0.004 Å
• c: 19.612 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3321.2 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0594
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for all reflections included in the refinement: 0.1059
• Goodness-of-fit parameter for all reflections included in the refinement: 1.202
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes