Information card for entry 4107650

Structure parameters

• Formula: C42 H48 F6 N9 O4 P Zn2
• Calculated formula: C42 H48 F6 N9 O4 P Zn2
• Title of publication: Distinguishing between Dexter and Rapid Sequential Electron Transfer in Covalently Linked Donor-Acceptor Assemblies
• Authors of publication: Monica Soler; James K. McCusker
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 4708 - 4724
• a: 13.2571 ± 0.0016 Å
• b: 22.498 ± 0.003 Å
• c: 14.956 ± 0.0018 Å
• α: 90°
• β: 99.742 ± 0.002°
• γ: 90°
• Cell volume: 4396.4 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0849
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.0671
• Weighted residual factors for all reflections included in the refinement: 0.0741
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No