Information card for entry 7130001

Structure parameters

• Mineral name: ?MFM-300-Sc_3ND3?
• Formula: C8 H4 D3.91 N1.3 O5 Sc
• Calculated formula: C8 H3.9998 D3.9134 N1.3044 O5 Sc
• Title of publication: High capacity ammonia adsorption in a robust metal–organic framework mediated by reversible host–guest interactions
• Authors of publication: Guo, Lixia; Han, Xue; Ma, Yujie; Li, Jiangnan; Lu, Wanpeng; Li, Weiyao; Lee, Daniel; da Silva, Ivan; Cheng, Yongqiang; Rudić, Svemir; Manuel, Pascal; Frogley, Mark D.; Ramirez-Cuesta, Anibal J.; Schröder, Martin; Yang, Sihai
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 15.402 ± 0.0003 Å
• b: 15.402 ± 0.0003 Å
• c: 12.3825 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2937.4 ± 0.11 ų
• Cell temperature: 7 K
• Ambient diffraction temperature: 7 K
• Number of distinct elements: 6
• Space group number: 98
• Hermann-Mauguin space group symbol: I 41 2 2
• Hall space group symbol: I 4bw 2bw
• Goodness-of-fit parameter for all reflections: 4.34
• Method of determination: powder diffraction
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No