Information card for entry 7055777

Structure parameters

• Formula: C19 H15 Cu N3 O3
• Calculated formula: C19 H15 Cu N3 O3
• SMILES: [Cu]12([N](N=C(O1)c1ccc(O)cc1)=Cc1c(O2)cccc1)[n]1ccccc1
• 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: 38.0051 ± 0.0015 Å
• b: 12.0227 ± 0.0003 Å
• c: 7.3639 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3364.7 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 45
• Hermann-Mauguin space group symbol: I b a 2
• Hall space group symbol: I 2 -2c
• Residual factor for all reflections: 0.0346
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0963
• Weighted residual factors for all reflections included in the refinement: 0.0974
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No