Information card for entry 4307090

Structure parameters

• Formula: C15 H24 Cu3 N6 O7
• Calculated formula: C15 H24 Cu3 N6 O7
• Title of publication: Supramolecular Assemblies of Trinuclear Triangular Copper(II) Secondary Building Units through Hydrogen Bonds. Generation of Different Metal-Organic Frameworks, Valuable Catalysts for Peroxidative Oxidation of Alkanes
• Authors of publication: Corrado Di Nicola; Yauhen Yu. Karabach; Alexander M. Kirillov; Magda Monari; Luciano Pandolfo; Claudio Pettinari; Armando J. L. Pombeiro
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 221 - 230
• a: 28.3701 ± 0.0014 Å
• b: 5.457 ± 0.0002 Å
• c: 28.1226 ± 0.0013 Å
• α: 90°
• β: 98.289 ± 0.002°
• γ: 90°
• Cell volume: 4308.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0999
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1251
• Weighted residual factors for all reflections included in the refinement: 0.1456
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No