Information card for entry 7241358

Structure parameters

• Formula: C18 H30 Cs N10 O7 Re6 Se8 Tb
• Calculated formula: C18 H28 Cs N10 O6 Re6 Se8 Tb
• Title of publication: Metal-organic frameworks with solvent-free lanthanide coordination environments: synthesis from aqueous ethanol solutions
• Authors of publication: Litvinova, Yulia M.; Gayfulin, Yakov M.; Brylev, Konstantin; Piryazev, Dmitry A.; van Leusen, Jan; Kögerler, Paul; Mironov, Yuri V.
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 10.8248 ± 0.0017 Å
• b: 10.8248 ± 0.0017 Å
• c: 32.123 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3259.8 ± 0.9 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 181
• Hermann-Mauguin space group symbol: P 64 2 2
• Hall space group symbol: P 64 2 (0 0 2)
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.1082
• Weighted residual factors for all reflections included in the refinement: 0.1108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No