Information card for entry 1544801

Structure parameters

• Formula: C26 H32 Cu2 N2 O8
• Calculated formula: C26 H32 Cu2 N2 O8
• Title of publication: Study of new Cu(II) metal-organic frameworks: Syntheses, structural, gas sorption and magnetic properties
• Authors of publication: Goel, Nidhi
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2016
• Journal volume: 450
• Pages of publication: 330 - 336
• a: 10.168 ± 0.002 Å
• b: 11.494 ± 0.003 Å
• c: 16.192 ± 0.003 Å
• α: 77.675 ± 0.012°
• β: 72.28 ± 0.011°
• γ: 63.88 ± 0.01°
• Cell volume: 1611.5 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0885
• Residual factor for significantly intense reflections: 0.0646
• Weighted residual factors for significantly intense reflections: 0.2007
• Weighted residual factors for all reflections included in the refinement: 0.2173
• Goodness-of-fit parameter for all reflections included in the refinement: 0.99
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No