Information card for entry 2210129

Structure parameters

• Chemical name: Bis(1,10-phenanthroline)[2-(2-pyridyl)-1<i>H</i>-benzimidazol-1-yl]ruthenium(II) perchlorate‒toluene‒acetonitrile (2/2/1)
• Formula: C44 H33.5 Cl N7.5 O4 Ru
• Calculated formula: C176 H134 Cl4 N30 O16 Ru4
• Title of publication: Bis(1,10-phenanthroline)[2-(2-pyridyl)-1<i>H</i>-benzimidazol-1-yl]ruthenium(II) perchlorate‒toluene‒acetonitrile (2/2/1)
• Authors of publication: Yun-Jun Liu; Hui Chao; Jun-Hua Yao; Yi-Xian Yuan; Liang-Nian Ji
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2128 - m2129
• a: 26.014 ± 0.011 Å
• b: 10.05 ± 0.004 Å
• c: 30.708 ± 0.013 Å
• α: 90°
• β: 93.223 ± 0.007°
• γ: 90°
• Cell volume: 8016 ± 6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0633
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1368
• Weighted residual factors for all reflections included in the refinement: 0.1404
• Goodness-of-fit parameter for all reflections included in the refinement: 1.279
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes