Information card for entry 7005726

Structure parameters

• Formula: C86 H80 Cl6 O6 P6 Pt2 Tl2
• Calculated formula: C86 H80 Cl6 O6 P6 Pt2 Tl2
• SMILES: C(#CC(C)(C)C)[Pt](P(=O)(c1ccccc1)c1ccccc1)(P(=O)(c1ccccc1)c1ccccc1)[P](c1ccccc1)([O]1[Tl][O]([Tl]1)[P](c1ccccc1)([Pt](C#CC(C)(C)C)(P(=O)(c1ccccc1)c1ccccc1)P(=O)(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl
• 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: 12.126 ± 0.002 Å
• b: 12.9612 ± 0.0018 Å
• c: 15.926 ± 0.002 Å
• α: 97.277 ± 0.017°
• β: 108.073 ± 0.017°
• γ: 112.454 ± 0.016°
• Cell volume: 2111.8 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0379
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0604
• Weighted residual factors for all reflections included in the refinement: 0.0637
• 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