Information card for entry 1508131

Structure parameters

• Formula: C480 H192 Cu24 O120
• Calculated formula: C480 H192 Cu24 O120
• Title of publication: De novo synthesis of a metal-organic framework material featuring ultrahigh surface area and gas storage capacities.
• Authors of publication: Farha, Omar K.; Yazaydın, A Özgür; Eryazici, Ibrahim; Malliakas, Christos D.; Hauser, Brad G.; Kanatzidis, Mercouri G.; Nguyen, SonBinh T; Snurr, Randall Q.; Hupp, Joseph T.
• Journal of publication: Nature chemistry
• Year of publication: 2010
• Journal volume: 2
• Journal issue: 11
• Pages of publication: 944 - 948
• a: 59.872 ± 0.002 Å
• b: 59.872 ± 0.002 Å
• c: 59.872 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 214621 ± 12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 225
• Hermann-Mauguin space group symbol: F m -3 m
• Hall space group symbol: -F 4 2 3
• Residual factor for all reflections: 0.2518
• Residual factor for significantly intense reflections: 0.138
• Weighted residual factors for significantly intense reflections: 0.2132
• Weighted residual factors for all reflections included in the refinement: 0.2692
• Goodness-of-fit parameter for all reflections included in the refinement: 1.244
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No