Information card for entry 4513172

Structure parameters

• Formula: C18 H14 N2 O6 S U
• Calculated formula: C18 H14 N2 O6 S U
• 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: 8.0279 ± 0.0006 Å
• b: 13.21 ± 0.001 Å
• c: 17.6516 ± 0.0013 Å
• α: 90°
• β: 91.59 ± 0.001°
• γ: 90°
• Cell volume: 1871.2 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.0878
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No