Information card for entry 7243956

Structure parameters

• Formula: C89.5 H112.5 N2.5 O41 Yb6
• Calculated formula: C88 H104 N2 O38 Yb6
• Title of publication: Fecht's acid revisited: a spirocyclic dicarboxylate for non-aromatic MOFs
• Authors of publication: Slyusarchuk, Valentyna D.; Hawes, Chris S.
• Journal of publication: CrystEngComm
• Year of publication: 2022
• Journal volume: 24
• Journal issue: 3
• Pages of publication: 484 - 490
• a: 12.4079 ± 0.0008 Å
• b: 20.8937 ± 0.0014 Å
• c: 19.4442 ± 0.0012 Å
• α: 90°
• β: 90.801 ± 0.002°
• γ: 90°
• Cell volume: 5040.4 ± 0.6 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0952
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for significantly intense reflections: 0.1442
• Weighted residual factors for all reflections included in the refinement: 0.1657
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No