Information card for entry 7118706

Structure parameters

• Formula: C288 H288 Ni12 O108 Pd12
• Calculated formula: C288 H288 Ni12 O108 Pd12
• Title of publication: Hetero-bimetallic metal-organic polyhedra.
• Authors of publication: Teo, Jesse M.; Coghlan, Campbell J.; Evans, Jack D.; Tsivion, Ehud; Head-Gordon, Martin; Sumby, Christopher J.; Doonan, Christian J.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 2
• Pages of publication: 276 - 279
• a: 29.174 ± 0.004 Å
• b: 29.174 ± 0.004 Å
• c: 41.296 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 35148 ± 10 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: 0.0833
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.2067
• Weighted residual factors for all reflections included in the refinement: 0.2183
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No