Information card for entry 7131944

Structure parameters

• Common name: SIFSIX
• Chemical name: [Cu2(Cu(pyac)2)2(SiF6)]n
• Formula: C40 H40 Cu3 F6 N4 O8 Si
• Calculated formula: C40 H40 Cu3 F6 N4 O8 Si
• Title of publication: A SIFSIX-MOF constructed from a metalloligand yields enhanced stability for selective CO2 adsorption
• Authors of publication: Tous-Granados , Alberto M.; Hernandez-Maldonado, Arturo J.
• Journal of publication: Chemical Communications
• Year of publication: 2023
• a: 19.0357 Å
• b: 8.0591 Å
• c: 19.0655 Å
• α: 90°
• β: 112.481°
• γ: 90°
• Cell volume: 2702.58 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Ambient diffracton pressure: 100 kPa
• Number of distinct elements: 7
• Space group number: 3
• Hermann-Mauguin space group symbol: P 1 2 1
• Hall space group symbol: P 2y
• Weighted residual factors for significantly intense reflections: 0.15463
• RFsqd: 0.78729
• Goodness-of-fit parameter for all reflections: 7.158
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No