Information card for entry 4101851

Structure parameters

• Formula: C32 H38 F24 N8 P4 Ru
• Calculated formula: C32 H38 F24 N8 P4 Ru
• Title of publication: Evolution of Linear Absorption and Nonlinear Optical Properties in V-Shaped Ruthenium(II)-Based Chromophores
• Authors of publication: Benjamin J. Coe; Simon P. Foxon; Elizabeth C. Harper; Madeleine Helliwell; James Raftery; Catherine A. Swanson; Bruce S. Brunschwig; Koen Clays; Edith Franz; Javier Garín; Jesús Orduna; Peter N. Horton; Michael B. Hursthouse
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 1706 - 1723
• a: 16.86 ± 0.07 Å
• b: 18.6 ± 0.03 Å
• c: 14.35 ± 0.05 Å
• α: 90°
• β: 95 ± 0.3°
• γ: 90°
• Cell volume: 4483 ± 3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• 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: 0.2326
• Residual factor for significantly intense reflections: 0.1418
• Weighted residual factors for significantly intense reflections: 0.3328
• Weighted residual factors for all reflections included in the refinement: 0.3951
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No