Information card for entry 7056540

Structure parameters

• Formula: C36 H74 Cl6 N20 O4
• Calculated formula: C36 H74.0004 Cl6.0002 N20 O3.9999
• Title of publication: Control of structure, stability and catechol oxidase activity of copper(II) complexes by the denticity of tripodal platforms
• Authors of publication: Matyuska, Ferenc; Nagy, Nora V.; Benyei, Attila; Gajda, Tamás
• Journal of publication: New J. Chem.
• Year of publication: 2017
• a: 18.125 ± 0.002 Å
• b: 18.125 ± 0.002 Å
• c: 18.125 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5954.3 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 197
• Hermann-Mauguin space group symbol: I 2 3
• Hall space group symbol: I 2 2 3
• Residual factor for all reflections: 0.0984
• Residual factor for significantly intense reflections: 0.0878
• Weighted residual factors for all reflections included in the refinement: 0.2403
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No