Information card for entry 1564650

Structure parameters

• Formula: C16 H18 Cu N4 O2 S2
• Calculated formula: C16 H18 Cu N4 O2 S2
• SMILES: C1(=N[N]([Cu]2(O1)[N](=C(C)C)N=C(c1cccs1)O2)=C(C)C)c1cccs1
• Title of publication: Monomeric and dimeric copper (II) complexes based on bidentate Nʹ-(propan-2-ylidene) thiophene carbohydrazide Schiff base ligand: Synthesis, structure, magnetic properties, antioxidant and anti-Alzheimer activities
• Authors of publication: Boulguemh, Imed-Eddine; Beghidja, Adel; Khattabi, Latifa; Long, Jérôme; Beghidja, Chahrazed
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 507
• Pages of publication: 119519
• a: 7.1221 ± 0.001 Å
• b: 11.9489 ± 0.0016 Å
• c: 10.8718 ± 0.0015 Å
• α: 90°
• β: 101.612 ± 0.003°
• γ: 90°
• Cell volume: 906.3 ± 0.2 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0884
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.1507
• Weighted residual factors for all reflections included in the refinement: 0.1733
• 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