Information card for entry 2001526

Structure parameters

• Formula: C29 H29 F6 N O P2 Ru
• Calculated formula: C29 H29 F6 N O P2 Ru
• Title of publication: (<i>tert</i>-Butyl isocyano-<i>C</i>)(carbonyl)(η^5^-cyclopentadienyl)(triphenylphosphine-<i>P</i>)ruthenium(II) hexafluorophosphate
• Authors of publication: Simpson, S. J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 7
• Pages of publication: 1333 - 1335
• a: 10.574 ± 0.003 Å
• b: 11.037 ± 0.003 Å
• c: 13.58 ± 0.004 Å
• α: 86.96 ± 0.02°
• β: 76.7 ± 0.02°
• γ: 78.32 ± 0.02°
• Cell volume: 1510.4 ± 0.8 ų
• Cell temperature: 294 ± 1 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 significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.0604
• Goodness-of-fit parameter for significantly intense reflections: 2.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No