Information card for entry 7028919

Structure parameters

• Formula: C39 H28 Cl4 F6 N10 O8 Ru
• Calculated formula: C39 H28 Cl4 F6 N10 O8 Ru
• Title of publication: The redox series [Ru(bpy)2(L)](n), n = +3, +2, +1, 0, with L = bipyridine, "click" derived pyridyl-triazole or bis-triazole: a combined structural, electrochemical, spectroelectrochemical and DFT investigation.
• Authors of publication: Hohloch, Stephan; Schweinfurth, David; Sommer, Michael G.; Weisser, Fritz; Deibel, Naina; Ehret, Fabian; Sarkar, Biprajit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 11
• Pages of publication: 4437 - 4450
• a: 11.199 ± 0.002 Å
• b: 12.433 ± 0.002 Å
• c: 16.087 ± 0.003 Å
• α: 89.218 ± 0.004°
• β: 87.674 ± 0.004°
• γ: 88.7 ± 0.004°
• Cell volume: 2237.3 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0936
• Residual factor for significantly intense reflections: 0.0821
• Weighted residual factors for significantly intense reflections: 0.2254
• Weighted residual factors for all reflections included in the refinement: 0.2396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No