Information card for entry 1100760

Structure parameters

• Formula: C46 H40 P2 Ru2 Se4
• Calculated formula: C46 H40 P2 Ru2 Se4
• SMILES: [Ru]12345([Se][Se][Ru]6789([Se][Se]1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[cH]1[cH]6[cH]7[cH]8[cH]91)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[cH]1[cH]2[cH]5[cH]4[cH]31
• Title of publication: Synthesis and Structural Characterization of Some Selenoruthenates and Telluroruthenates
• Authors of publication: Sergey M. Dibrov; Bin Deng; Donald E. Ellis; James A. Ibers
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 3441 - 3448
• a: 9.5419 ± 0.0014 Å
• b: 11.8807 ± 0.0017 Å
• c: 11.9229 ± 0.0018 Å
• α: 93.561 ± 0.003°
• β: 93.604 ± 0.003°
• γ: 109.951 ± 0.002°
• Cell volume: 1263 ± 0.3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0686
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1192
• Weighted residual factors for all reflections included in the refinement: 0.1295
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No