Information card for entry 7119131

Structure parameters

• Formula: C41 H32 Cl8 P2 Pt
• Calculated formula: C41 H32 Cl8 P2 Pt
• SMILES: [Pt]1(Cl)(Cl)[P](C(=C=C([P]1(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.ClC(Cl)Cl.ClC(Cl)Cl
• Title of publication: Bis-phosphine allene ligand: coordination chemistry and preliminary applications in catalysis
• Authors of publication: Avassaya Vanitcha; Cecilia Damelincourt; Geoffrey Gontard; Nicolas Vanthuyne; Virginie Mouries-Mansuy; Louis Fensterbank
• Journal of publication: Chem.Commun.
• Year of publication: 2016
• Journal volume: 52
• Pages of publication: 6785
• a: 9.9582 ± 0.0003 Å
• b: 21.3845 ± 0.0007 Å
• c: 10.1108 ± 0.0003 Å
• α: 90°
• β: 103.135 ± 0.002°
• γ: 90°
• Cell volume: 2096.78 ± 0.11 ų
• Cell temperature: 200 ± 1 K
• Ambient diffraction temperature: 200 ± 1 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0184
• Residual factor for significantly intense reflections: 0.0183
• Weighted residual factors for significantly intense reflections: 0.0464
• Weighted residual factors for all reflections included in the refinement: 0.0466
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No