Information card for entry 4132436

Structure parameters

• Formula: C14 H20 F6 Fe N P
• Calculated formula: C14 H20 F6 Fe N P
• Title of publication: pH-Driven Mechanistic Switching from Electron Transfer to Energy Transfer between [Ru(bpy)₃]²⁺ and Ferrocene Derivatives.
• Authors of publication: Drolen, Claire; Conklin, Eric; Hetterich, Stephen J.; Krishnamurthy, Aditi; Andrade, Gabriel A.; Dimeglio, John L.; Martin, Maxwell I.; Tran, Linh K.; Yap, Glenn P. A.; Rosenthal, Joel; Young, Elizabeth R.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 32
• Pages of publication: 10169 - 10178
• a: 9.842 ± 0.002 Å
• b: 13.966 ± 0.003 Å
• c: 12.181 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1674.3 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 57
• Hermann-Mauguin space group symbol: P b c m
• Hall space group symbol: -P 2c 2b
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.1401
• Weighted residual factors for all reflections included in the refinement: 0.1484
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No