Information card for entry 4067923

Structure parameters

• Formula: C12 H8 F6 N2 O6 Pt S2
• Calculated formula: C12 H8 F6 N2 O6 Pt S2
• Title of publication: Activation of Anisole by Organoplatinum(II) Complexes: Evidence for Rate-Determining C‒H Activation
• Authors of publication: Bonnington, Kevin J.; Zhang, Fenbao; Moustafa, Mahmoud M. Abd Rabo; Cooper, Benjamin F. T.; Jennings, Michael C.; Puddephatt, Richard J.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 1
• Pages of publication: 306
• a: 13.341 ± 0.005 Å
• b: 15.255 ± 0.005 Å
• c: 9.055 ± 0.005 Å
• α: 90 ± 0.005°
• β: 111.923 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 1709.6 ± 1.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0461
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0849
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections included in the refinement: 0.771
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No