Information card for entry 4102792

Structure parameters

• Formula: C72 H76 F P3 Pt
• Calculated formula: C72 H76 F P3 Pt
• SMILES: [Pt]1([P](Cc2c1cccc2)(C12CC3CC(C1)CC(C2)C3)C12CC3CC(C2)CC(C1)C3)([P](c1ccccc1)(c1ccccc1)c1ccccc1)c1c(cc(cc1CF)C)C.P(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Reagent-Dependent Formation of C-C and C-F Bonds in Pt Complexes: An Unexpected Twist in the Electrophilic Fluorination Chemistry
• Authors of publication: Ariela W. Kaspi; Israel Goldberg; Arkadi Vigalok
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 10626 - 10627
• a: 11.34 ± 0.0002 Å
• b: 15.621 ± 0.0003 Å
• c: 18.5266 ± 0.0005 Å
• α: 66.7454 ± 0.0011°
• β: 80.2447 ± 0.001°
• γ: 73.5493 ± 0.0013°
• Cell volume: 2885.6 ± 0.11 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0771
• Residual factor for significantly intense reflections: 0.0594
• Weighted residual factors for significantly intense reflections: 0.1007
• Weighted residual factors for all reflections included in the refinement: 0.1068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No