Information card for entry 4129073

Structure parameters

• Formula: C63 H36 N6 O33 Rh6
• Calculated formula: C63 H36 N6 O33 Rh6
• Title of publication: Phase Transfer of Rhodium(II)-Based Metal-Organic Polyhedra Bearing Coordinatively-Bound Cargo Enables Molecular Separation.
• Authors of publication: Grancha, Thais; Carne-Sanchez, Arnau; Hernández-López, Laura; Albalad, Jorge; Imaz, Inhar; Juanhuix, Judith; Maspoch, Daniel
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• a: 29.44 ± 0.004 Å
• b: 29.44 ± 0.004 Å
• c: 41.56 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 36021 ± 8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 87
• Hermann-Mauguin space group symbol: I 4/m
• Hall space group symbol: -I 4
• Residual factor for all reflections: 0.0998
• Residual factor for significantly intense reflections: 0.0945
• Weighted residual factors for significantly intense reflections: 0.3583
• Weighted residual factors for all reflections included in the refinement: 0.3806
• Goodness-of-fit parameter for all reflections included in the refinement: 1.973
• Diffraction radiation wavelength: 0.72656 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No