Information card for entry 2243578

Structure parameters

• Chemical name: Triethylammonium hexabromidouranate(IV) dichloromethane monosolvate
• Formula: C13 H34 Br6 Cl2 N2 U
• Calculated formula: C13 H34 Br6 Cl2 N2 U
• SMILES: [U](Br)(Br)(Br)(Br)([Br-])[Br-].ClCCl.[NH+](CC)(CC)CC.[NH+](CC)(CC)CC
• Title of publication: Synthesis and crystal structure of triethylammonium hexabromidouranate(IV) dichloromethane monosolvate
• Authors of publication: Deubner, Holger Lars; Koester, Marcel; von Haenisch, Carsten; Kraus, Florian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 10
• Pages of publication: 1587 - 1590
• a: 10.7318 ± 0.0004 Å
• b: 17.4541 ± 0.0004 Å
• c: 15.0082 ± 0.0004 Å
• α: 90°
• β: 92.055 ± 0.001°
• γ: 90°
• Cell volume: 2809.44 ± 0.14 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0302
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.0573
• Weighted residual factors for all reflections included in the refinement: 0.0594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No