Information card for entry 7042596

Structure parameters

• Formula: C34 H38 Cl2 N4 O4 U
• Calculated formula: C34 H38 Cl2 N4 O4 U
• SMILES: C1C[C@H]2[N]3=Cc4c(c(ccc4)OCC)O[U]43([n]3ccccc3)(Cl)([N]([C@@H]2CC1)=Cc1c(c(ccc1)OCC)O4)Cl.n1ccccc1.C1C[C@@H]2[N]3=Cc4c(c(ccc4)OCC)O[U]43([n]3ccccc3)(Cl)([N]([C@H]2CC1)=Cc1c(c(ccc1)OCC)O4)Cl.n1ccccc1
• Title of publication: Schiff base thorium(iv) and uranium(iv) chloro complexes: synthesis, substitution and oxidation chemistry.
• Authors of publication: Stobbe, Brian C.; Powell, Douglas R.; Thomson, Robert K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 15
• Pages of publication: 4888 - 4892
• a: 19.233 ± 0.006 Å
• b: 19.034 ± 0.006 Å
• c: 12.202 ± 0.004 Å
• α: 90°
• β: 122.796 ± 0.003°
• γ: 90°
• Cell volume: 3755 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0713
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.1118
• Weighted residual factors for all reflections included in the refinement: 0.1424
• 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: No
• Has Fobs: No