Information card for entry 7225402

Structure parameters

• Formula: C26 H38 Cu N8 O10 S2
• Calculated formula: C26 H38 Cu N8 O10 S2
• SMILES: c1(ccccc1NN=C(C(=O)C)C(=O)C)S(O[Cu]12([NH2]CC[NH2]1)([NH2]CC[NH2]2)OS(=O)(c1ccccc1NN=C(C(=O)C)C(=O)C)=O)(=O)=O
• Title of publication: Reaction of sodium 2-(2-(2,4-dioxopentan-3-ylidene)hydrazinyl) benzenesulfonate with ethylenediamine on Cu(II) and Ni(II) centres: efficient Cu(II) homogeneous catalysts for cyanosilylation of aldehydes
• Authors of publication: Mahmoud, Abdallah G.; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 7.4179 ± 0.0004 Å
• b: 20.0875 ± 0.0012 Å
• c: 11.2037 ± 0.0007 Å
• α: 90°
• β: 106.071 ± 0.002°
• γ: 90°
• Cell volume: 1604.19 ± 0.16 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0484
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0971
• Weighted residual factors for all reflections included in the refinement: 0.103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No