Information card for entry 7705491

Structure parameters

• Formula: C28 H18 Cu N2 O12
• Calculated formula: C28 H18 Cu N2 O12
• Title of publication: Metal organic frameworks decorated with free carboxylic acid groups: topology, metal capture and dye adsorption properties.
• Authors of publication: Ahamad, M. Naqi; Khan, M. Shahnawaz; Shahid, M.; Ahmad, Musheer
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 41
• Pages of publication: 14690 - 14705
• a: 10.6268 ± 0.0006 Å
• b: 11.0196 ± 0.0006 Å
• c: 22.5383 ± 0.0013 Å
• α: 90°
• β: 101.724 ± 0.003°
• γ: 90°
• Cell volume: 2584.2 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0473
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0865
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No