Information card for entry 7237254

Structure parameters

• Chemical name: UTSA-120
• Formula: C24 H16 Cu F6 N12 Si
• Calculated formula: C24 H16 Cu F6 N12 Si
• Title of publication: A metal‒organic framework with suitable pore size and dual functionalities for highly efficient post-combustion CO2 capture
• Authors of publication: Wen, Hui-Min; Liao, Caijun; Li, Libo; Alsalme, Ali; Alothman, Zeid; Krishna, Rajamani; Wu, Hui; Zhou, Wei; Hu, Jun; Chen, Banglin
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 7
• Pages of publication: 3128
• a: 15.123 ± 0.0011 Å
• b: 15.123 Å
• c: 7.8349 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1791.88 ± 0.17 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 139
• Hermann-Mauguin space group symbol: I 4/m m m
• Hall space group symbol: -I 4 2
• RFsqd: 0.09273
• Goodness-of-fit parameter for all reflections: 1.5
• Method of determination: powder diffraction
• Diffraction radiation probe: neutron
• Diffraction radiation wavelength: 2.0775 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No