Information card for entry 4302727

Structure parameters

• Formula: C21 H27 F6 O4 P Pt
• Calculated formula: C21 H27 F6 O4 P Pt
• SMILES: [Pt]12([P](c3c([C]1(=[CH2]2)C)cccc3)(C(C)(C)C)C(C)(C)C)(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F
• Title of publication: Mononuclear Platinum(II) Complexes Incorporating κ2-Carboxylate Ligands: Synthesis, Structure, and Reactivity
• Authors of publication: Marc-Etienne Moret; Sebastian F. Keller; J. Chris Slootweg; Peter Chen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 6972 - 6978
• a: 10.8654 ± 0.0003 Å
• b: 15.9547 ± 0.0006 Å
• c: 14.0385 ± 0.0004 Å
• α: 90°
• β: 95.003 ± 0.002°
• γ: 90°
• Cell volume: 2424.36 ± 0.13 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0505
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0815
• Weighted residual factors for all reflections included in the refinement: 0.0899
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No