Information card for entry 7700045

Structure parameters

• Chemical name: Lithium 12-crown-4 neptunyl tetrachloride
• Formula: C16 Cl4 Li2 Np O10
• Calculated formula: C16 Cl4 Li2 Np O10
• Title of publication: Actinyl-cation interactions: experimental and theoretical assessment of [Np(vi)O₂Cl₄]^2- and [U(vi)O₂Cl₄]^2- systems.
• Authors of publication: Bjorklund, Jennifer L.; Pyrch, Mikaela M.; Basile, Madeline C.; Mason, Sara E.; Forbes, Tori Z.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 24
• Pages of publication: 8861 - 8871
• a: 13.115 ± 0.008 Å
• b: 13.371 ± 0.007 Å
• c: 14.838 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2602 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 69
• Hermann-Mauguin space group symbol: F m m m
• Hall space group symbol: -F 2 2
• Residual factor for all reflections: 0.0419
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1088
• Weighted residual factors for all reflections included in the refinement: 0.1088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No