Information card for entry 7121691

Structure parameters

• Formula: C168 O70 Th12
• Calculated formula: C168 O70 Th12
• Title of publication: Synthesis and structural characterization of the first neptunium based metal-organic frameworks incorporating {Np₆O₈} hexanuclear clusters.
• Authors of publication: Martin, N. P.; März, J; Feuchter, H.; Duval, S.; Roussel, P.; Henry, N.; Ikeda-Ohno, A; Loiseau, T.; Volkringer, C.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 51
• Pages of publication: 6979 - 6982
• a: 27.996 ± 0.0015 Å
• b: 27.996 ± 0.0015 Å
• c: 27.996 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 21943 ± 2 ų
• Cell temperature: 299.18 K
• Ambient diffraction temperature: 299.18 K
• Number of distinct elements: 3
• Space group number: 225
• Hermann-Mauguin space group symbol: F m -3 m
• Hall space group symbol: -F 4 2 3
• Residual factor for all reflections: 0.0611
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.1371
• Weighted residual factors for all reflections included in the refinement: 0.1508
• Goodness-of-fit parameter for all reflections included in the refinement: 1.302
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No