Information card for entry 7009356

Structure parameters

• Formula: C13 H21 N O5 S U
• Calculated formula: C13 H21 N O5 S U
• Title of publication: Synthesis, structure and reactivity of trans-UO22+ complexes of OH-containing ligands †
• Authors of publication: Venkateswara Rao, P.; Rao, Chebrolu P.; Sreedhara, Alavattam; Wegelius, Elina K.; Rissanen, Kari; Kolehmainen, Erkki
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 7
• Pages of publication: 1213
• a: 7.534 ± 0.002 Å
• b: 17.011 ± 0.007 Å
• c: 13.069 ± 0.004 Å
• α: 90°
• β: 97.11 ± 0.02°
• γ: 90°
• Cell volume: 1662.1 ± 1 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.077
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for all reflections: 0.1538
• Weighted residual factors for significantly intense reflections: 0.144
• Goodness-of-fit parameter for all reflections: 0.956
• Goodness-of-fit parameter for significantly intense reflections: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No