Information card for entry 7234018

Structure parameters

• Formula: C8 H7 Nd O9
• Calculated formula: C8 H7 Nd O9
• Title of publication: Series of 3D lanthanide MOFs derived from saddle-like alicyclic tetracarboxylate ligands: synthesis, characterization and structure‒photoluminescence correlations
• Authors of publication: Wang, Jia-Yin; Shi, Yang; Tao, Dong-Liang; Bo, Qi-Bing
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 43
• Pages of publication: 6591
• a: 7.0897 ± 0.0003 Å
• b: 8.0981 ± 0.0005 Å
• c: 9.2634 ± 0.0005 Å
• α: 67.362 ± 0.005°
• β: 86.126 ± 0.004°
• γ: 82.729 ± 0.004°
• Cell volume: 486.81 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0197
• Residual factor for significantly intense reflections: 0.0178
• Weighted residual factors for significantly intense reflections: 0.0413
• Weighted residual factors for all reflections included in the refinement: 0.0422
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No