Information card for entry 4069794

Structure parameters

• Common name: 3b, (dippdmae)Pt(CF3CCPh)
• Formula: C19 H29 F3 N P Pt
• Calculated formula: C19 H29 F3 N P Pt
• SMILES: [Pt]12([P](C(C)C)(C(C)C)CC[N]1(C)C)[C](#[C]2C(F)(F)F)c1ccccc1
• Title of publication: Reactivity Differences of Pt0Phosphine Complexes in C−C Bond Activation of Asymmetric Acetylenes
• Authors of publication: Gunay, Ahmet; Müller, Christian; Lachicotte, Rene J.; Brennessel, William W.; Jones, William D.
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 22
• Pages of publication: 6524
• a: 8.2861 ± 0.0005 Å
• b: 14.1213 ± 0.0008 Å
• c: 18.2354 ± 0.0011 Å
• α: 90°
• β: 99.688 ± 0.001°
• γ: 90°
• Cell volume: 2103.3 ± 0.2 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0316
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0507
• Weighted residual factors for all reflections included in the refinement: 0.0518
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No