Information card for entry 7701918

Structure parameters

• Formula: C32 H44 N4 O12 Ru4
• Calculated formula: C32 H44 N4 O12 Ru4
• 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: 9.9499 ± 0.0003 Å
• b: 11.2978 ± 0.0003 Å
• c: 18.7038 ± 0.0005 Å
• α: 85.935 ± 0.002°
• β: 89.215 ± 0.002°
• γ: 70.044 ± 0.002°
• Cell volume: 1971.19 ± 0.1 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 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: 0.0359
• Residual factor for significantly intense reflections: 0.0281
• Weighted residual factors for significantly intense reflections: 0.0627
• Weighted residual factors for all reflections included in the refinement: 0.0669
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No