Information card for entry 4076677

Structure parameters

• Common name: (P-N)Pt(C4Ph4)
• Formula: C39 H46 Cl2 N P Pt
• Calculated formula: C39 H46 Cl2 N P Pt
• SMILES: C(Cl)Cl.[Pt]12(C(=C(C(=C2c2ccccc2)c2ccccc2)c2ccccc2)c2ccccc2)[P](CC[N]1(C)C)(C(C)C)C(C)C
• Title of publication: Chelating P,N versus P,P Ligands: Differing Reactivity of Donor-Stabilized Pt(η2-PhC⋮CPh) Complexes Toward Diphenylacetylene
• Authors of publication: Müller, Christian; Lachicotte, Rene J.; Jones, William D.
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Journal issue: 6
• Pages of publication: 1118
• a: 11.7422 ± 0.0011 Å
• b: 11.8833 ± 0.0011 Å
• c: 26.064 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3636.9 ± 0.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1081
• Residual factor for significantly intense reflections: 0.0827
• Weighted residual factors for significantly intense reflections: 0.1478
• Weighted residual factors for all reflections included in the refinement: 0.1565
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No