Information card for entry 4316084

Structure parameters

• Common name: uranyl-3-aminomethylaniline(Me-3,2-HOPO)2
• Formula: C24 H28 N4 O10 S U
• Calculated formula: C24 H28 N4 O10 S U
• Title of publication: Influence of Linker Geometry on Uranyl Complexation by Rigidly Linked Bis(3-hydroxy-N-methyl-pyridin-2-one)
• Authors of publication: Géza Szigethy; Kenneth N. Raymond
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 6755 - 6765
• a: 8.8897 ± 0.0018 Å
• b: 13.317 ± 0.003 Å
• c: 13.577 ± 0.003 Å
• α: 64.277 ± 0.003°
• β: 75.544 ± 0.003°
• γ: 71.472 ± 0.003°
• Cell volume: 1361.2 ± 0.5 ų
• Cell temperature: 165 ± 2 K
• Ambient diffraction temperature: 165 ± 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: 0.0532
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.092
• Weighted residual factors for all reflections included in the refinement: 0.0956
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No