Information card for entry 7014996

Structure parameters

• Formula: C15 H15 Cl3 F N Pt
• Calculated formula: C15 H15 Cl3 F N Pt
• SMILES: [Pt]1([n]2c(cccc2c2ccc(F)cc12)C(C)(C)C)(Cl)(Cl)Cl
• Title of publication: Platinum(IV) centres with agostic interactions from either sp² or sp³ C-H bonds.
• Authors of publication: Crosby, Sarah H.; Deeth, Robert J.; Clarkson, Guy J.; Rourke, Jonathan P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 6
• Pages of publication: 1227 - 1229
• a: 13.0861 ± 0.0002 Å
• b: 8.07835 ± 0.0001 Å
• c: 15.9059 ± 0.0003 Å
• α: 90°
• β: 111.752 ± 0.0019°
• γ: 90°
• Cell volume: 1561.75 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.027
• Residual factor for significantly intense reflections: 0.0204
• Weighted residual factors for significantly intense reflections: 0.042
• Weighted residual factors for all reflections included in the refinement: 0.0428
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No