Information card for entry 4001405

Structure parameters

• Formula: C2 H4 F2 O6 Pb2 S2
• Calculated formula: C2 H4 F2 O6 Pb2 S2
• Title of publication: A Metal−Organic Framework Containing Cationic Inorganic Layers: Pb2F2[C2H4(SO3)2]
• Authors of publication: Rogow, David L.; Zapeda, Gustavo; Swanson, Claudia H.; Fan, Xiaojuan; Oliver, Allen G.; Oliver, Scott R. J.
• Journal of publication: Chemistry of Materials
• Year of publication: 2007
• Journal volume: 19
• Journal issue: 19
• Pages of publication: 4658
• a: 21.4829 ± 0.001 Å
• b: 4.6185 ± 0.0002 Å
• c: 8.8453 ± 0.0004 Å
• α: 90°
• β: 100.362 ± 0.001°
• γ: 90°
• Cell volume: 863.31 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0883
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.1297
• Weighted residual factors for all reflections included in the refinement: 0.1394
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No