Information card for entry 2009931

Structure parameters

• Chemical name: Cyclopentadienylbis(triphenylphosphine)(thioacetamide)ruthenium(II) tetrafluoroborate
• Formula: C43 H40 B F4 N P2 Ru S
• Calculated formula: C43 H40 B F4 N P2 Ru S
• Title of publication: Cyclopentadienyl(thioacetamide-<i>S</i>)bis(triphenylphosphine-<i>P</i>)ruthenium(II) tetrafluoroborate
• Authors of publication: Bryan, C. D.; Cordes, A.W.; Draganjac, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 8
• Pages of publication: 1231 - 1233
• a: 13.6 ± 0.002 Å
• b: 14.8693 ± 0.0013 Å
• c: 19.444 ± 0.003 Å
• α: 90°
• β: 91.6 ± 0.01°
• γ: 90°
• Cell volume: 3930.5 ± 0.9 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for all reflections: 0.07
• Weighted residual factors for significantly intense reflections: 0.059
• Goodness-of-fit parameter for significantly intense reflections: 1.09
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No