Information card for entry 4076675

Structure parameters

• Common name: (P-N)Pt(PhCCPh)
• Formula: C24.5 H35 Cl N P Pt
• Calculated formula: C24.5 H35 Cl N P Pt
• SMILES: C(Cl)Cl.[Pt]12([P](CC[N]1(C)C)(C(C)C)C(C)C)[C](#[C]2c1ccccc1)c1ccccc1
• 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: 28.4815 ± 0.0016 Å
• b: 11.7883 ± 0.0007 Å
• c: 15.045 ± 0.0009 Å
• α: 90°
• β: 100.97 ± 0.001°
• γ: 90°
• Cell volume: 4959 ± 0.5 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: 0.1135
• Residual factor for significantly intense reflections: 0.0663
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1383
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No