Information card for entry 7062666

Structure parameters

• Formula: C648 H396 Cd17 O96
• Calculated formula: C648 H388 Cd17 O96
• Title of publication: Fluorescent cadmium(ii) metal–organic frameworks exhibit excellent stability and detection ability to Fe3+ and MnO4− ions
• Authors of publication: Cen, Peipei; Ma, Tongtong; Jiang, Fujunrui; Zhang, Fengyuan; He, Yanping; Ding, Runmei; Tian, Danian
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 35
• Pages of publication: 16741 - 16747
• a: 17.9028 ± 0.0005 Å
• b: 38.1443 ± 0.0011 Å
• c: 31.7645 ± 0.0009 Å
• α: 90°
• β: 98.922 ± 0.002°
• γ: 90°
• Cell volume: 21429.2 ± 1.1 ų
• Cell temperature: 190 ± 2 K
• Ambient diffraction temperature: 189.98 K
• Number of distinct elements: 4
• 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: 0.1537
• Residual factor for significantly intense reflections: 0.0902
• Weighted residual factors for significantly intense reflections: 0.276
• Weighted residual factors for all reflections included in the refinement: 0.3258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No