Information card for entry 2233835

Structure parameters

• Chemical name: (Butan-2-ol-κ<i>O</i>)[2-({(ethylsulfanyl)[2-(2-oxidobenzylidene- κ<i>O</i>)hydrazinylidene-κ<i>N</i>^2^]methyl}iminomethyl)phenolato- κ<i>O</i>]dioxidouranium(VI)
• Formula: C21 H25 N3 O5 S U
• Calculated formula: C20.998 H25 N2.998 O5 S U
• Title of publication: (Butan-2-ol-κ<i>O</i>)[2-({(ethylsulfanyl)[2-(2-oxidobenzylidene-κ<i>O</i>)hydrazinylidene-κ<i>N</i>^2^]methyl}iminomethyl)phenolato-κ<i>O</i>]dioxidouranium(VI)
• Authors of publication: Takjoo, Reza; Najafi, Atefeh; Ng, Seik Weng; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: m255 - m256
• a: 11.3803 ± 0.0002 Å
• b: 14.3999 ± 0.0003 Å
• c: 14.0264 ± 0.0004 Å
• α: 90°
• β: 97.326 ± 0.002°
• γ: 90°
• Cell volume: 2279.81 ± 0.09 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0511
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.0776
• Goodness-of-fit parameter for all reflections included in the refinement: 1.158
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes