Information card for entry 7702735

Structure parameters

• Formula: C122 H106 Cl4 O12 P6 Ru6
• Calculated formula: C61.01 H55.02 Cl2.02 O6 P3 Ru3
• Title of publication: Acetylide generation and coupling on electron-rich Ru3 clusters
• Authors of publication: Low, Paul J.; Hayes, Tim M.; Udachin, Konstantin A.; Goeta, Andres E.; Howard, Judith A. K.; Enright, Gary D.; Carty, Arthur J.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 7
• Pages of publication: 1455
• a: 12.0485 ± 0.001 Å
• b: 12.9634 ± 0.001 Å
• c: 20.482 ± 0.002 Å
• α: 72.421 ± 0.01°
• β: 87.32 ± 0.01°
• γ: 89.122 ± 0.01°
• Cell volume: 3046.3 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1385
• Weighted residual factors for all reflections included in the refinement: 0.1481
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No