Information card for entry 1548310

Structure parameters

• Formula: C8 H8 Cu F6 N4 Si
• Calculated formula: C8 H8 Cu F6 N4 Si
• Title of publication: Made-to-order metal-organic frameworks for trace carbon dioxide removal and air capture
• Authors of publication: Shekhah, Osama; Belmabkhout, Youssef; Chen, Zhijie; Guillerm, Vincent; Cairns, Amy; Adil, Karim; Eddaoudi, Mohamed
• Journal of publication: Nature Communications
• Year of publication: 2014
• Journal volume: 5
• Pages of publication: 4228
• a: 6.9186 ± 0.0002 Å
• b: 6.9186 ± 0.0002 Å
• c: 7.9061 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 378.44 ± 0.02 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 6
• Space group number: 123
• Hermann-Mauguin space group symbol: P 4/m m m
• Hall space group symbol: -P 4 2
• Residual factor R(I) for significantly intense reflections: 5.1628
• Goodness-of-fit parameter for all reflections: 20.7
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No