Information card for entry 4336532

Structure parameters

• Formula: C24 H18 N2 O6 U
• Calculated formula: C24 H18 N2 O6 U
• SMILES: [U]123(=O)(=O)([O]=C(O1)c1ccccc1)([O]=C(O2)c1ccccc1)[n]1ccccc1c1[n]3cccc1
• Title of publication: Synthesis, Structures, and Properties of Uranyl Hybrids Constructed by a Variety of Mono- and Polycarboxylic Acids
• Authors of publication: Weiting Yang; Song Dang; Hao Wang; Tao Tian; Qing-Jiang Pan; Zhong-Ming Sun
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 12394 - 12402
• a: 8.8559 ± 0.0014 Å
• b: 9.0269 ± 0.0014 Å
• c: 14.43 ± 0.002 Å
• α: 88.123 ± 0.003°
• β: 80.122 ± 0.003°
• γ: 74.356 ± 0.003°
• Cell volume: 1094.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0569
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.0989
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No