Information card for entry 7036588

Structure parameters

• Formula: C339 H273 B16 Co4 F64 N75 O6 Ru4
• Calculated formula: C339 H273 B12 Co4 F48 N75 O6 Ru4
• Title of publication: Stepwise assembly of mixed-metal coordination cages containing both kinetically inert and kinetically labile metal ions: introduction of metal-centred redox and photophysical activity at specific sites.
• Authors of publication: Wragg, Ashley B.; Metherell, Alexander J.; Cullen, William; Ward, Michael D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 41
• Pages of publication: 17939 - 17949
• a: 34.091 ± 0.002 Å
• b: 34.091 ± 0.002 Å
• c: 35.5084 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 35739 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1299
• Residual factor for significantly intense reflections: 0.0773
• Weighted residual factors for significantly intense reflections: 0.2194
• Weighted residual factors for all reflections included in the refinement: 0.246
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No