Information card for entry 7704316

Structure parameters

• Formula: C28 H20 Br3 N6 Ru2
• Calculated formula: C28 H20 Br3 N6 Ru2
• Title of publication: Structural, spectroscopic and electronic properties of a family of face-shared bi-octahedral Ru₂^5+/6+ complexes with a bridging 2,5-di(2-pyridyl)pyrrolide ligand.
• Authors of publication: Kang, Shi-Rui; Zhou, Zi-Qin; Xiong, Chang-Feng; Liu, Bin; McGrady, John E.; Obies, Mohammed; Liu, Chao; He, Piao; Yi, Xiao-Yi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 21
• Pages of publication: 7053 - 7059
• a: 9.6819 ± 0.0006 Å
• b: 13.4083 ± 0.0009 Å
• c: 22.4107 ± 0.0015 Å
• α: 90°
• β: 101.786 ± 0.004°
• γ: 90°
• Cell volume: 2848 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0528
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0633
• Weighted residual factors for all reflections included in the refinement: 0.0714
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No