Information card for entry 4321358

Structure parameters

• Formula: C47 H41 F6 N4 O2 P3 Ru
• Calculated formula: C47 H41 F5 N4 O2 P3 Ru
• Title of publication: Chemistry of Metal-Bound Anion Radicals. A Family of Mono- and Bis(azopyridine) Chelates of Bivalent Ruthenium
• Authors of publication: Maya Shivakumar; Kausikisankar Pramanik; Indranil Bhattacharyya; Animesh Chakravorty
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 4332 - 4338
• a: 9.433 ± 0.002 Å
• b: 38.914 ± 0.017 Å
• c: 13.084 ± 0.003 Å
• α: 90°
• β: 103.47 ± 0.02°
• γ: 90°
• Cell volume: 4671 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1372
• Residual factor for significantly intense reflections: 0.0828
• Weighted residual factors for all reflections: 0.3961
• Weighted residual factors for significantly intense reflections: 0.2049
• Goodness-of-fit parameter for all reflections: 1.163
• Goodness-of-fit parameter for significantly intense reflections: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No