Information card for entry 4112033

Structure parameters

• Formula: C38.5 H21 B Cl3 F15 N2 O2 Pt
• Calculated formula: C38.5 H21 B Cl3 F15 N2 O2 Pt
• Title of publication: Activation of C-H Bonds of Arenes: Selectivity and Reactivity in Bis(pyridyl) Platinum(II) Complexes
• Authors of publication: Fenbao Zhang; Christopher W. Kirby; Douglas W. Hairsine; Michael C. Jennings; Richard J. Puddephatt
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Pages of publication: 14196 - 14197
• a: 14.6798 ± 0.0005 Å
• b: 20.7799 ± 0.0006 Å
• c: 25.5737 ± 0.0008 Å
• α: 90°
• β: 91.802 ± 0.002°
• γ: 90°
• Cell volume: 7797.3 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.1233
• Residual factor for significantly intense reflections: 0.0605
• Weighted residual factors for significantly intense reflections: 0.138
• Weighted residual factors for all reflections included in the refinement: 0.163
• Goodness-of-fit parameter for all reflections included in the refinement: 0.956
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No