Information card for entry 4513175

Structure parameters

• Formula: C20.5 H14.75 N2 O6.38 S U0.75
• Calculated formula: C20.5 H14.75 N2 O6.375 S U0.75
• Title of publication: Role of N-Donor Sterics on the Coordination Environment and Dimensionality of Uranyl Thiophenedicarboxylate Coordination Polymers
• Authors of publication: Thangavelu, Sonia G.; Butcher, Ray J.; Cahill, Christopher L.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 7
• Pages of publication: 3481
• a: 11.4282 ± 0.0011 Å
• b: 20.119 ± 0.002 Å
• c: 20.412 ± 0.002 Å
• α: 81.576 ± 0.001°
• β: 77.945 ± 0.001°
• γ: 78.047 ± 0.001°
• Cell volume: 4464 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1325
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1403
• Weighted residual factors for all reflections included in the refinement: 0.1695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No