Information card for entry 7237253

Structure parameters

• Chemical name: UTSA-120
• Formula: C26.6 H16 Cu F6 N12 O5.2 Si
• Calculated formula: C26.608 H16 Cu F6 N12 O5.216 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: 15.1068 ± 0.0013 Å
• b: 15.1068 Å
• c: 7.998 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1825.3 ± 0.2 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 7
• Space group number: 139
• Hermann-Mauguin space group symbol: I 4/m m m
• Hall space group symbol: -I 4 2
• RFsqd: 0.18664
• Goodness-of-fit parameter for all reflections: 1.04
• Method of determination: powder diffraction
• Diffraction radiation probe: neutron
• Diffraction radiation wavelength: 2.0775 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No