Information card for entry 4077125

Structure parameters

• Formula: C31 H43 F3 O2 P2 Pt
• Calculated formula: C31 H43 F3 O2 P2 Pt
• SMILES: [Pt]1234([P](CC)(CC)CC)([P](CC)(CC)CC)[c]5([c]1([cH]2[cH]3[cH]45)c1ccccc1)c1ccccc1.FC(F)(F)C(=O)[O-]
• Title of publication: Rearrangement of a σ-2-(Cycloprop-2-enyl)vinyl- to an η3-Cyclopentadienylplatinum(II) Complex. Selective Protonolysis of the Platinum−Methyl Bond
• Authors of publication: Jacob, Volker; Weakley, Timothy J. R.; Haley, Michael M.
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Journal issue: 24
• Pages of publication: 5394
• a: 8.4097 ± 0.0006 Å
• b: 10.9877 ± 0.0006 Å
• c: 17.809 ± 0.001 Å
• α: 103.727 ± 0.005°
• β: 90.644 ± 0.006°
• γ: 94.374 ± 0.005°
• Cell volume: 1593.22 ± 0.17 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.036
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for all reflections: 0.055
• Weighted residual factors for all reflections included in the refinement: 0.028
• Goodness-of-fit parameter for all reflections: 1.38
• Goodness-of-fit parameter for all reflections included in the refinement: 1.41
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No