Information card for entry 7009562

Structure parameters

• Formula: C88 H86 O8 P2 Ru2
• Calculated formula: C88 H86 O8 P2 Ru2
• Title of publication: Oligomerisation of alkynes at a pentamethylcyclopentadienylruthenium centre †
• Authors of publication: Bruce, Michael I.; Hall, Ben C.; Skelton, Brian W.; White, Allan H.; Zaitseva, Natasha N.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 14
• Pages of publication: 2279
• a: 22.569 ± 0.005 Å
• b: 18.155 ± 0.004 Å
• c: 9.376 ± 0.003 Å
• α: 76.66 ± 0.02°
• β: 83.89 ± 0.02°
• γ: 84.74 ± 0.02°
• Cell volume: 3707.9 ± 1.7 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.085
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for all reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.073
• Goodness-of-fit parameter for all reflections: 1.582
• Goodness-of-fit parameter for all reflections included in the refinement: 1.748
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No