Information card for entry 4347907

Structure parameters

• Common name: Cd-FPAA-1
• Chemical name: Cd-FPAA-1
• Formula: C54 H42 Cd3 F6 N8 O14
• Calculated formula: C54 H42 Cd3 F6 N8 O14
• Title of publication: Functionalization and Isoreticulation in a Series of Metal-Organic Frameworks Derived from Pyridinecarboxylates.
• Authors of publication: Pachfule, Pradip; Garai, Bikash; Banerjee, Rahul
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 15
• Pages of publication: 7200 - 7205
• a: 10.6945 ± 0.0012 Å
• b: 18.576 ± 0.002 Å
• c: 14.9208 ± 0.0017 Å
• α: 90°
• β: 107.758 ± 0.002°
• γ: 90°
• Cell volume: 2822.9 ± 0.5 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 6
• 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: 0.0701
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1359
• Weighted residual factors for all reflections included in the refinement: 0.1471
• Goodness-of-fit parameter for all reflections included in the refinement: 0.905
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No