Information card for entry 7025287

Structure parameters

• Formula: C60 H86 Br2 Cl6 N6 O5 P2
• Calculated formula: C60 H85 Br2 Cl6 N6 O5 P2
• Title of publication: Novel class of functionalized ionic liquids with grafted CMPO-moieties for actinides and rare-earth elements recovery.
• Authors of publication: Odinets, Irina L.; Sharova, Elena V.; Artyshin, Oleg I.; Lyssenko, Konstantin A.; Nelyubina, Yulia V.; Myasoedova, Galina V.; Molochnikova, Nadezhda P.; Zakharchenro, Elena A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 17
• Pages of publication: 4170 - 4178
• a: 23.9357 ± 0.0016 Å
• b: 11.7625 ± 0.0008 Å
• c: 25.1174 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7071.6 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0637
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.1056
• Weighted residual factors for all reflections included in the refinement: 0.1233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No