Information card for entry 4345240

Structure parameters

• Formula: C26 H21 Co F12 N13 P2
• Calculated formula: C26 H21 Co F12 N13 P2
• Title of publication: High-Voltage Dye-Sensitized Solar Cells Mediated by [Co(2,2′-bipyrimidine)3]z
• Authors of publication: Chen, Kitty Y.; Du, Chuan; Patrick, Brian O.; Berlinguette, Curtis P.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2017
• a: 10.5717 ± 0.0006 Å
• b: 11.7075 ± 0.0007 Å
• c: 14.1419 ± 0.0008 Å
• α: 74.819 ± 0.002°
• β: 81.563 ± 0.002°
• γ: 75.111 ± 0.002°
• Cell volume: 1626.59 ± 0.16 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: 0.0594
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.1187
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No