Information card for entry 7018186

Structure parameters

• Common name: bis(2,2'-Bipyridyl)(1,6,7,12-tetraazaperylene)-ruthenium(ii) bis(hexafluorophosphate)
• Chemical name: bis(2,2'-Bipyridyl)(1,6,7,12-tetraazaperylene)-ruthenium(ii) bis(hexafluorophosphate)
• Formula: C40.5 H29.5 F12 N8.5 P2 Ru
• Calculated formula: C37 H25.5 F12 N8.5 P2 Ru
• Title of publication: Mono- and dinuclear ruthenium(ii) 1,6,7,12-tetraazaperylene complexes.
• Authors of publication: Brietzke, Thomas; Mickler, Wulfhard; Kelling, Alexandra; Holdt, Hans-Jürgen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 9
• Pages of publication: 2788 - 2797
• a: 10.9023 ± 0.0013 Å
• b: 12.5034 ± 0.0014 Å
• c: 16.734 ± 0.0018 Å
• α: 76.174 ± 0.009°
• β: 76.325 ± 0.009°
• γ: 83.086 ± 0.009°
• Cell volume: 2147.3 ± 0.4 ų
• Cell temperature: 210 ± 2 K
• Ambient diffraction temperature: 210 ± 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: 0.0484
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.0959
• Weighted residual factors for all reflections included in the refinement: 0.0988
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No