Information card for entry 7227449

Structure parameters

• Formula: C24 H24 B2 Cu F8 N4
• Calculated formula: C24 H24 B2 Cu F8 N4
• SMILES: [Cu]12([n]3c(c4[n]2c(ccc4)C)cccc3C)[n]2c(c3[n]1c(ccc3)C)cccc2C.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-]
• Title of publication: Efficient dye-sensitized solar cells with [copper(6,6′-dimethyl-2,2′-bipyridine)2]2+/1+ redox shuttle
• Authors of publication: Li, Jiajia; Yang, Xichuan; Yu, Ze; Gurzadyan, Gagik G.; Cheng, Ming; Zhang, Fuguo; Cong, Jiayan; Wang, Weihan; Wang, Haoxin; Li, Xiaoxin; Kloo, Lars; Wang, Mei; Sun, Licheng
• Journal of publication: RSC Adv.
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 8
• Pages of publication: 4611
• a: 10.1099 ± 0.0007 Å
• b: 14.5192 ± 0.001 Å
• c: 18.8693 ± 0.0014 Å
• α: 73.736 ± 0.004°
• β: 86.862 ± 0.004°
• γ: 78.123 ± 0.004°
• Cell volume: 2602 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0678
• Residual factor for significantly intense reflections: 0.0559
• Weighted residual factors for significantly intense reflections: 0.1695
• Weighted residual factors for all reflections included in the refinement: 0.1777
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No