Information card for entry 4503547

Structure parameters

• Formula: C21 H13 N3 O17 Th
• Calculated formula: C21 H13 N3 O17 Th
• Title of publication: Thorium(IV) Coordination Polymers in the Pyridine and Pyrazinedicarboxylic Acid Systems
• Authors of publication: Frisch, Mark; Cahill, Christopher L.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2008
• Journal volume: 8
• Journal issue: 8
• Pages of publication: 2921
• a: 7.9925 ± 0.0005 Å
• b: 9.3928 ± 0.0006 Å
• c: 9.4723 ± 0.0006 Å
• α: 69.789 ± 0.001°
• β: 84.958 ± 0.001°
• γ: 69.425 ± 0.001°
• Cell volume: 624.3 ± 0.07 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0226
• Residual factor for significantly intense reflections: 0.0226
• Weighted residual factors for significantly intense reflections: 0.0458
• Weighted residual factors for all reflections included in the refinement: 0.0458
• Goodness-of-fit parameter for all reflections included in the refinement: 0.861
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No