Information card for entry 7113283

Structure parameters

• Formula: C70 H52 F6 N13 O4 P Ru2
• Calculated formula: C70 H52 F6 N13 O4 P Ru2
• Title of publication: Cyclometalated ruthenium complexes for sensitizing nanocrystalline TiO2 solar cells
• Authors of publication: Wadman, Sipke H.; Kroon, Jan M.; Bakker, Klaas; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2007
• Journal issue: 19
• Pages of publication: 1907 - 1909
• a: 9.535 ± 0.0001 Å
• b: 15.4639 ± 0.0002 Å
• c: 21.5139 ± 0.0003 Å
• α: 97.2304 ± 0.0004°
• β: 96.0597 ± 0.0005°
• γ: 92.7702 ± 0.0006°
• Cell volume: 3123.27 ± 0.07 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.05
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0878
• Weighted residual factors for all reflections included in the refinement: 0.0955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7101892
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No