Information card for entry 7110529

Structure parameters

• Formula: C18 H36 F6 O6 Ru S2 Se6
• Calculated formula: C18 H36 F6 O6 Ru S2 Se6
• SMILES: C[Se]1[Ru]234([Se](CC(C1)(C)C[Se]3C)C)[Se](C)CC(C)(C[Se]2C)C[Se]4C.C(F)(F)(S(=O)(=O)[O-])F.C(F)(F)(F)S(=O)(=O)[O-]
• Title of publication: [Ru{MeC(CH2EMe)3}2](CF3SO3)2: the first homoleptic hexaseleno- and hexatelluro-ether complexes
• Authors of publication: Levason, William; Orchard, Simon D.; Reid, Gillian
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 12
• Pages of publication: 1071
• a: 8.8436 ± 0.0005 Å
• b: 11.6692 ± 0.0015 Å
• c: 8.7056 ± 0.0008 Å
• α: 107.369 ± 0.009°
• β: 91.648 ± 0.007°
• γ: 106.53 ± 0.007°
• Cell volume: 815.63 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0539
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.1011
• Weighted residual factors for all reflections included in the refinement: 0.1106
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No