Information card for entry 7060443

Structure parameters

• Formula: C28 H19 Cd N8 O8
• Calculated formula: C28 H19 Cd N8 O8
• Title of publication: Construction of a series of metal-directed MOFs to explore their physical and chemical properties
• Authors of publication: Akhtar, Sohel; Singha, Pabitra; De, Avik; Das, Krishna Sundar; Saha, Sayan; Bala, Sukhen; Mondal, Raju
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 6438 - 6449
• a: 12.7472 ± 0.0015 Å
• b: 17.173 ± 0.002 Å
• c: 13.6504 ± 0.0016 Å
• α: 90°
• β: 110.216 ± 0.003°
• γ: 90°
• Cell volume: 2804.1 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.073
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.099
• Weighted residual factors for all reflections included in the refinement: 0.1073
• Goodness-of-fit parameter for all reflections included in the refinement: 1.309
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No