Information card for entry 7019366

Structure parameters

• Formula: C82.5 H108 Cl N2 O3 U
• Calculated formula: C58 H80 Cl N2 O3 U
• Title of publication: Rigid NON- and NSN-ligand complexes of tetravalent and trivalent uranium: comparison of U-OAr(2) and U-SAr(2) bonding.
• Authors of publication: Vidjayacoumar, Balamurugan; Ilango, Sougandi; Ray, Matthew J.; Chu, Terry; Kolpin, Kristopher B.; Andreychuk, Nicholas R.; Cruz, Carlos A.; Emslie, David J. H.; Jenkins, Hilary A.; Britten, James F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 26
• Pages of publication: 8175 - 8189
• a: 14.402 ± 0.002 Å
• b: 15.964 ± 0.002 Å
• c: 29.638 ± 0.005 Å
• α: 90°
• β: 94.854 ± 0.003°
• γ: 90°
• Cell volume: 6789.7 ± 1.7 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: 0.1248
• Residual factor for significantly intense reflections: 0.0781
• Weighted residual factors for significantly intense reflections: 0.1973
• Weighted residual factors for all reflections included in the refinement: 0.2135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No