Information card for entry 4307228

Structure parameters

• Chemical name: LnPF-2
• Formula: C40 H36 Nd4 O32 S8
• Calculated formula: C40 H36 Nd4 O32 S8
• Title of publication: Rare Earth Arenedisulfonate Metal-Organic Frameworks: An Approach toward Polyhedral Diversity and Variety of Functional Compounds
• Authors of publication: Felipe Gándara; Alberto García-Cortés; Concepción Cascales; Berta Gómez-Lor; Enrique Gutiérrez-Puebla; Marta Iglesias; Angeles Monge; Natalia Snejko
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 3475 - 3484
• a: 19.5105 ± 0.0014 Å
• b: 10.5594 ± 0.0008 Å
• c: 25.3401 ± 0.0018 Å
• α: 90°
• β: 98.448 ± 0.001°
• γ: 90°
• Cell volume: 5163.9 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0557
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.0866
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No