Information card for entry 7700578

Structure parameters

• Formula: C23 H25 F12 N5 O P2 Ru
• Calculated formula: C23 H25 F12 N5 O P2 Ru
• Title of publication: Fundamental electron-transfer and proton-coupled electron-transfer properties of Ru(iv)-oxo complexes.
• Authors of publication: Kotani, Hiroaki; Shimomura, Hinatsu; Horimoto, Momoka; Ishizuka, Tomoya; Shiota, Yoshihito; Yoshizawa, Kazunari; Yanagisawa, Sachiko; Kawahara-Nakagawa, Yuka; Kubo, Minoru; Kojima, Takahiko
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 35
• Pages of publication: 13154 - 13161
• a: 8.0227 ± 0.0016 Å
• b: 17.867 ± 0.004 Å
• c: 10.601 ± 0.002 Å
• α: 90°
• β: 109.214 ± 0.002°
• γ: 90°
• Cell volume: 1434.9 ± 0.5 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0234
• Residual factor for significantly intense reflections: 0.0223
• Weighted residual factors for significantly intense reflections: 0.0571
• Weighted residual factors for all reflections included in the refinement: 0.0578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No