Information card for entry 7021839

Structure parameters

• Formula: C32 H27 F3 N O2 P Pt
• Calculated formula: C32 H27 F3 N O2 P Pt
• SMILES: [Pt]([P](c1ccccc1)(c1ccccc1)c1ccccc1)([n]1c(cccc1)c1ccccc1)(OC(=O)C(F)(F)F)C
• Title of publication: Selectivity in metal-carbon bond protonolysis in p-tolyl- (or methyl)-cycloplatinated(ii) complexes: kinetics and mechanism of the uncatalyzed isomerization of the resulting Pt(ii) products.
• Authors of publication: Haghighi, Mohsen Golbon; Nabavizadeh, S. Masoud; Rashidi, Mehdi; Kubicki, Maciej
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 37
• Pages of publication: 13369 - 13380
• a: 10.2693 ± 0.0017 Å
• b: 11.313 ± 0.0007 Å
• c: 13.852 ± 0.002 Å
• α: 87.14 ± 0.008°
• β: 72.665 ± 0.015°
• γ: 70.061 ± 0.009°
• Cell volume: 1441.7 ± 0.4 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.033
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0701
• Weighted residual factors for all reflections included in the refinement: 0.0728
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No