Information card for entry 7005727

Structure parameters

• Common name: s63
• Formula: C42 H41 O3 P3 Pt
• Calculated formula: C42 H41 O3 P3 Pt
• SMILES: [Pt](P(=O)(c1ccccc1)c1ccccc1)([P](O)(c1ccccc1)c1ccccc1)([P](O)(c1ccccc1)c1ccccc1)C#CC(C)(C)C
• Title of publication: One-dimensional phosphinite platinum chains based on hydrogen bonding interactions and phosphinite tetranuclear platinum(II)-thallium(I) complexes.
• Authors of publication: Díez, Alvaro; Forniés, Juan; Gómez, Julio; Lalinde, Elena; Martín, Antonio; Moreno, M. Teresa; Sánchez, Sergio
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 33
• Pages of publication: 3653 - 3660
• a: 17.1175 ± 0.0004 Å
• b: 18.3866 ± 0.0004 Å
• c: 24.3578 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7666.2 ± 0.3 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0992
• Residual factor for significantly intense reflections: 0.0559
• Weighted residual factors for significantly intense reflections: 0.0707
• Weighted residual factors for all reflections included in the refinement: 0.0796
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No