Information card for entry 4075536

Structure parameters

• Formula: C23 H24 F3 O3 P Pd S
• Calculated formula: C23 H24 F3 O3 P Pd S
• Title of publication: Syntheses and Structures of Bulky Monophosphine-Ligated Methylpalladium Complexes: Application to Homo- and Copolymerization of Norbornene and/or Methoxycarbonylnorbornene
• Authors of publication: Yamashita, Makoto; Takamiya, Ikuko; Jin, Koichiro; Nozaki, Kyoko
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 19
• Pages of publication: 4588
• a: 9.727 ± 0.002 Å
• b: 10.568 ± 0.002 Å
• c: 13.079 ± 0.003 Å
• α: 67.835 ± 0.011°
• β: 74.702 ± 0.012°
• γ: 72.953 ± 0.011°
• Cell volume: 1172.4 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 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 all reflections: 0.0211
• Residual factor for significantly intense reflections: 0.0202
• Weighted residual factors for significantly intense reflections: 0.0519
• Weighted residual factors for all reflections included in the refinement: 0.0524
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No