Information card for entry 7042534

Structure parameters

• Formula: C59 H48 N6 O17 U2
• Calculated formula: C59 H48 N6 O17 U2
• Title of publication: X-Ray crystallographic and computational study on uranyl-salophen complexes bearing nitro groups.
• Authors of publication: Valkonen, Arto; Lombardo, Giuseppe M.; Rissanen, Kari; Punzo, Francesco; Cametti, Massimo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 16
• Pages of publication: 5240 - 5249
• a: 11.6878 ± 0.0003 Å
• b: 12.1737 ± 0.0003 Å
• c: 12.4532 ± 0.0004 Å
• α: 73.37 ± 0.002°
• β: 66.535 ± 0.002°
• γ: 83.915 ± 0.002°
• Cell volume: 1557.31 ± 0.08 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0366
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No