Information card for entry 4307091

Structure parameters

• Formula: C15 H22 Cu3 N6 O6
• Calculated formula: C15 H22 Cu3 N6 O6
• 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: 8.0167 ± 0.0009 Å
• b: 10.259 ± 0.0011 Å
• c: 13.4531 ± 0.0015 Å
• α: 69.777 ± 0.003°
• β: 88.217 ± 0.003°
• γ: 80.496 ± 0.003°
• Cell volume: 1023.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0936
• Residual factor for significantly intense reflections: 0.0753
• Weighted residual factors for significantly intense reflections: 0.2038
• Weighted residual factors for all reflections included in the refinement: 0.2186
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No