Information card for entry 4349652

Structure parameters

• Formula: C28 H42.5 Cu2 N5 O19
• Calculated formula: C28 H42.5 Cu2 N5 O19
• Title of publication: Self-assembly generation, structural features, and oxidation catalytic properties of new aqua-soluble copper(ii)-aminoalcohol derivatives
• Authors of publication: Kirillova, Marina V.; Santos, Carla I. M.; André, Vânia; Fernandes, Tiago A.; Dias, Sara S. P.; Kirillov, Alexander M.
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 6
• Pages of publication: 968
• a: 7.9872 ± 0.0003 Å
• b: 13.4223 ± 0.0005 Å
• c: 17.0038 ± 0.0007 Å
• α: 75.041 ± 0.002°
• β: 89.602 ± 0.002°
• γ: 83.83 ± 0.002°
• Cell volume: 1750.53 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1005
• Residual factor for significantly intense reflections: 0.0727
• Weighted residual factors for significantly intense reflections: 0.1616
• Weighted residual factors for all reflections included in the refinement: 0.1804
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No