Information card for entry 7701922

Structure parameters

• Formula: C142 H122 O22 P6 Ru6
• Calculated formula: C130 H98 O19 P6 Ru6
• Title of publication: [Ru₃(6-NHC)(CO)₁₀]: synthesis, characterisation and reactivity of rare 46-electron tri-ruthenium clusters.
• Authors of publication: Ellul, Charles E.; Lowe, John P.; Mahon, Mary F.; Raithby, Paul R.; Whittlesey, Michael K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 13
• Pages of publication: 4518 - 4523
• a: 13.975 ± 0.0004 Å
• b: 22.2953 ± 0.0008 Å
• c: 24.5968 ± 0.0009 Å
• α: 69.887 ± 0.003°
• β: 73.57 ± 0.003°
• γ: 81.586 ± 0.003°
• Cell volume: 6892.3 ± 0.4 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 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: 0.1597
• Residual factor for significantly intense reflections: 0.0971
• Weighted residual factors for significantly intense reflections: 0.206
• Weighted residual factors for all reflections included in the refinement: 0.2257
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No