Information card for entry 4101901

Structure parameters

• Formula: C52 H42 Cu F6 N8 O16 Re2 S2
• Calculated formula: C52 H42 Cu F6 N8 O16 Re2 S2
• Title of publication: Orbital-Specific Energy Transfer
• Authors of publication: Troy E. Knight; James K. McCusker
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 2208 - 2221
• a: 10.3213 ± 0.0012 Å
• b: 24.532 ± 0.003 Å
• c: 12.1608 ± 0.0014 Å
• α: 90°
• β: 104.027 ± 0.002°
• γ: 90°
• Cell volume: 2987.3 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0225
• Residual factor for significantly intense reflections: 0.0189
• Weighted residual factors for significantly intense reflections: 0.0432
• Weighted residual factors for all reflections included in the refinement: 0.0443
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No