Information card for entry 1577449

Structure parameters

• Chemical name: NU-2503
• Formula: C11 H7 O8 Yb
• Calculated formula: C11 H7 O8 Yb
• Title of publication: Mapping the crystallization landscape of rare earth MOFs: a high-throughput investigation of structure, kinetics, and selectivity
• Authors of publication: Gaidimas, Madeleine A.; Kim, Gyu-Hee; Ye, Zi-Ming; Magdalenski, Julian S.; Barker, Nathaniel M.; Mandal, Abhijoy; Darvish, Kourosh; Kirlikovali, Kent O.; Bernales, Varinia; Aspuru-Guzik, Alán; Malliakas, Christos D.; Farha, Omar K.
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 10.9117 ± 0.0019 Å
• b: 16.7852 ± 0.0017 Å
• c: 6.7375 ± 0.0008 Å
• α: 90°
• β: 102.767 ± 0.014°
• γ: 90°
• Cell volume: 1203.5 ± 0.3 ų
• Cell temperature: 293 ± 5 K
• Ambient diffraction temperature: 293 ± 5 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.222
• Residual factor for significantly intense reflections: 0.1945
• Weighted residual factors for significantly intense reflections: 0.4489
• Weighted residual factors for all reflections included in the refinement: 0.4636
• Goodness-of-fit parameter for all reflections included in the refinement: 1.171
• Diffraction radiation probe: electron
• Diffraction radiation wavelength: 0.0251 Å
• Diffraction radiation type: electron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No