Information card for entry 7202008

Structure parameters

• Formula: C6 H4 N2 O7 U
• Calculated formula: C6 H4 N2 O7 U
• Title of publication: Hydrothermal synthesis of uranyl‒organic frameworks with pyrazine-2,3-dicarboxylate linkers
• Authors of publication: Masci, Bernardo; Thuéry, Pierre
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 8
• Pages of publication: 1082
• a: 9.2125 ± 0.0006 Å
• b: 11.6265 ± 0.0005 Å
• c: 9.8446 ± 0.0007 Å
• α: 90°
• β: 102.397 ± 0.003°
• γ: 90°
• Cell volume: 1029.86 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0194
• Residual factor for significantly intense reflections: 0.0185
• Weighted residual factors for significantly intense reflections: 0.0439
• Weighted residual factors for all reflections included in the refinement: 0.0442
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No