Information card for entry 7110946

Structure parameters

• Formula: C20 H17 N7 O13.5 Sm
• Calculated formula: C20 H16 N7 O13.5 Sm
• Title of publication: Lanthanide co-ordination frameworks of 4,4′-bipyridine-N,N′-dioxide
• Authors of publication: Long, De-Liang; Blake, Alexander J.; Champness, Neil R.; Schröder, Martin
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 15
• Pages of publication: 1369
• a: 16.529 ± 0.004 Å
• b: 17.616 ± 0.005 Å
• c: 17.244 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5021 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0438
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for significantly intense reflections: 0.0686
• Weighted residual factors for all reflections included in the refinement: 0.0772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No