Information card for entry 2207323

Structure parameters

• Chemical name: (acetonitrile)[4-(4-bromophenyl)-2,6-di-2-pyridyl-1,3,5-triazine](1,3-di-2- pyridyl-2,3-dihydro-1H-imidazolyl)ruthenium(II) bis(hexafluorophosphate
• Formula: C35 H26.5 Br F12 N10.5 P2 Ru
• Calculated formula: C35 H26.5 Br F12 N10.5 P2 Ru
• Title of publication: A hybrid bidentate and tridentate ruthenium(II) complex incorporating triazine and polypyridine carbene ligands
• Authors of publication: Medlycott, Elaine A.; Schaper, Frank; Hanan, Garry S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: m2311 - m2313
• a: 37.3866 ± 0.0004 Å
• b: 13.9391 ± 0.0002 Å
• c: 15.3229 ± 0.0002 Å
• α: 90°
• β: 105.906 ± 0.001°
• γ: 90°
• Cell volume: 7679.57 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0332
• Residual factor for significantly intense reflections: 0.0331
• Weighted residual factors for significantly intense reflections: 0.0877
• Weighted residual factors for all reflections included in the refinement: 0.0878
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No