Information card for entry 7244137

Structure parameters

• Formula: C10 H16 N3 O9 Y
• Calculated formula: C10 H16 N3 O9 Y
• Title of publication: The solvent influenced coordination variation of flexible ligands to Y(iii) towards MOF structural diversity
• Authors of publication: Park, Jiwon; Koo, Jin Young; Choi, Hee Cheul
• Journal of publication: CrystEngComm
• Year of publication: 2022
• Journal volume: 24
• Journal issue: 4
• Pages of publication: 846 - 853
• a: 12.47 ± 0.003 Å
• b: 10.334 ± 0.002 Å
• c: 13.219 ± 0.003 Å
• α: 90°
• β: 111.93 ± 0.03°
• γ: 90°
• Cell volume: 1580.2 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0621
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.1544
• Weighted residual factors for all reflections included in the refinement: 0.1583
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.8 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No