Information card for entry 1564506

Structure parameters

• Formula: C26 H22 Cu N8 O2
• Calculated formula: C26 H22 Cu N8 O2
• SMILES: [Cu]1234(OC(=N[N]4=C(c4[n]2cccc4)C)c2cccnc2)OC(=N[N]1=C(c1[n]3cccc1)C)c1cnccc1
• Title of publication: Copper(II) and zinc(II) complexes with Hydrazone: Synthesis, crystal structure, Hirshfeld surface and antibacterial activity
• Authors of publication: Santiago, Pedro H.O.; Santiago, Mariana B.; Martins, Carlos H.G.; Gatto, Claudia C.
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 508
• Pages of publication: 119632
• a: 10.2854 ± 0.0017 Å
• b: 39.205 ± 0.006 Å
• c: 11.94 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4814.7 ± 1.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 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: 0.1536
• Residual factor for significantly intense reflections: 0.0641
• Weighted residual factors for significantly intense reflections: 0.1269
• Weighted residual factors for all reflections included in the refinement: 0.1712
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No