Information card for entry 1517856

Structure parameters

• Formula: C58 H77 N O5 Te U
• Calculated formula: C58 H77 N O5 Te U
• SMILES: [U]123([TeH])(Oc4c(C[N]3(Cc3c(O1)c(cc(c3)C)C13CC5CC(CC(C1)C5)C3)Cc1c(O2)c(cc(c1)C)C12CC3CC(CC(C1)C3)C2)cc(cc4C12CC3CC(CC(C1)C3)C2)C)[O](C)CCOC
• Title of publication: Reactivity of uranium(iii) with H2E (E = S, Se, Te): synthesis of a series of mononuclear and dinuclear uranium(iv) hydrochalcogenido complexes
• Authors of publication: Franke, Sebastian M.; Rosenzweig, Michael W.; Heinemann, Frank W.; Meyer, Karsten
• Journal of publication: Chem. Sci.
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 1
• Pages of publication: 275
• a: 11.2439 ± 0.0015 Å
• b: 12.9994 ± 0.0017 Å
• c: 18.636 ± 0.003 Å
• α: 102.273 ± 0.004°
• β: 101.519 ± 0.004°
• γ: 100.806 ± 0.004°
• Cell volume: 2531.7 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0215
• Residual factor for significantly intense reflections: 0.0205
• Weighted residual factors for significantly intense reflections: 0.0514
• Weighted residual factors for all reflections included in the refinement: 0.0518
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No