Information card for entry 1561099

Structure parameters

• Formula: C10 H25 Cm N2 O11
• Calculated formula: C10 H25 Cm N2 O11
• Title of publication: Advancing understanding of actinide(iii) (Ac, Am, Cm) aqueous complexation chemistry
• Authors of publication: Jones, Zachary R.; Livshits, Maksim Y.; White, Frankie D.; Dalodière, Elodie; Ferrier, Maryline G.; Lilley, Laura M.; Knope, Karah E.; Kozimor, Stosh A.; Mocko, Veronika; Scott, Brian L.; Stein, Benjamin W.; Wacker, Jennifer N.; Woen, David H.
• Journal of publication: Chemical Science
• Year of publication: 2021
• Journal volume: 12
• Journal issue: 15
• Pages of publication: 5638 - 5654
• a: 6.7801 ± 0.0003 Å
• b: 15.0056 ± 0.0007 Å
• c: 20.489 ± 0.001 Å
• α: 90°
• β: 97.24 ± 0.001°
• γ: 90°
• Cell volume: 2067.92 ± 0.17 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298.06 K
• Number of distinct elements: 5
• 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: 0.0289
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.0638
• Weighted residual factors for all reflections included in the refinement: 0.0652
• Goodness-of-fit parameter for all reflections included in the refinement: 1.171
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No