Information card for entry 7062701

Structure parameters

• Formula: C28 H21 Cd N5 O4
• Calculated formula: C28 H21 Cd N5 O4
• Title of publication: Selective dye sorption and metal ion sensing behaviours of a new Cd-based MOF
• Authors of publication: Manna, Priyanka; Hasija, Avantika; Chopra, Deepak; Mahata, Partha
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 43
• Pages of publication: 19846 - 19855
• a: 15.0905 ± 0.001 Å
• b: 18.1837 ± 0.0009 Å
• c: 28.8807 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7924.9 ± 0.7 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 5
• Space group number: 64
• Hermann-Mauguin space group symbol: C m c e
• Hall space group symbol: -C 2ac 2
• Residual factor for all reflections: 0.0971
• Residual factor for significantly intense reflections: 0.0875
• Weighted residual factors for significantly intense reflections: 0.1996
• Weighted residual factors for all reflections included in the refinement: 0.2046
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No