Information card for entry 7055778

Structure parameters

• Formula: C60.5 H53.5 Cu4 N8 O21.5
• Calculated formula: C60.5 H53.5 Cu4 N8 O21.5
• SMILES: [Cu]1234[N](N=C(O1)c1ccc(O)cc1)=Cc1c5[O]2[Cu]26([O]7[Cu]89([N](N=C(O8)c8ccc(O)cc8)=Cc8c%10[O]9[Cu]9%11([N](N=C(O9)c9ccc(O)cc9)=Cc9c([O]3%11)c([O]4C)ccc9)[O](c%10ccc8)C)[O](c3c7c(C=[N]2N=C(O6)c2ccc(O)cc2)ccc3)C)[O](c5ccc1)C.O.O.O.O.OC.O
• Title of publication: Copper(ii) hydrazone complexes with different nuclearities and geometries: synthetic methods and ligand substituent effects
• Authors of publication: Vrdoljak, Višnja; Pavlović, Gordana; Maltar-Strmečki, Nadica; Cindrić, Marina
• Journal of publication: New J. Chem.
• Year of publication: 2016
• Journal volume: 40
• Journal issue: 11
• Pages of publication: 9263
• a: 25.8273 ± 0.0011 Å
• b: 21.2967 ± 0.0016 Å
• c: 23.5033 ± 0.0015 Å
• α: 90°
• β: 94.619 ± 0.005°
• γ: 90°
• Cell volume: 12885.7 ± 1.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1545
• Residual factor for significantly intense reflections: 0.0894
• Weighted residual factors for significantly intense reflections: 0.181
• Weighted residual factors for all reflections included in the refinement: 0.2066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No