Information card for entry 7700056

Structure parameters

• Formula: C37 H39 N P2 Ru
• Calculated formula: C37 H39 N P2 Ru
• Title of publication: The MMCT excited state of a localized mixed valence cyanido-bridged Ru^II-Ru-Ru^II complex.
• Authors of publication: Su, Shao-Dong; Zhu, Xiao-Quan; Zhang, Lin-Tao; Yang, Yu-Ying; Wen, Yue-Hong; Wu, Xin-Tao; Yang, Song-Qiu; Sheng, Tian-Lu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 25
• Pages of publication: 9303 - 9309
• a: 11.154 ± 0.005 Å
• b: 17.875 ± 0.007 Å
• c: 16.895 ± 0.009 Å
• α: 90°
• β: 108.837 ± 0.008°
• γ: 90°
• Cell volume: 3188 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0603
• Weighted residual factors for all reflections included in the refinement: 0.0627
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No