Information card for entry 7103012

Structure parameters

• Formula: C78 H162 Cr3 F8 N3 O12
• Calculated formula: C78 H162 Cr3 F8 N3 O12
• Title of publication: Chemistry and supramolecular chemistry of chromium horseshoes.
• Authors of publication: Rancan, Marzio; Newton, Graham N; Muryn, Christopher A; Pritchard, Robin G; Timco, Grigore A; Cronin, Leroy; Winpenny, Richard E P
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 13
• Pages of publication: 1560 - 1562
• a: 16.835 ± 0.005 Å
• b: 17.057 ± 0.005 Å
• c: 18.219 ± 0.005 Å
• α: 71.765 ± 0.005°
• β: 85.874 ± 0.005°
• γ: 72.304 ± 0.005°
• Cell volume: 4732 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1461
• Residual factor for significantly intense reflections: 0.0892
• Weighted residual factors for significantly intense reflections: 0.2409
• Weighted residual factors for all reflections included in the refinement: 0.2909
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No