Information card for entry 4318372

Structure parameters

• Chemical name: [Pt(PP3)Cl]Cl.6H2O
• Formula: C42 H42 Cl2 O5.5 P4 Pt
• Calculated formula: C42 H42 Cl2 O5.5 P4 Pt
• SMILES: [Pt]123(Cl)[P](c4ccccc4)(c4ccccc4)CC[P]1(CC[P]2(c1ccccc1)c1ccccc1)CC[P]3(c1ccccc1)c1ccccc1.[Cl-].O.O.O.O.O.O
• Title of publication: Preparation and Structural Characterization of Ionic Five-Coordinate Palladium(II) and Platinum(II) Complexes of the Ligand Tris[2-(diphenylphosphino)ethyl]phosphine. Insertion of SnCl2 into M-Cl Bonds (M = Pd, Pt) and Hydroformylation Activity of the Pt-SnCl3 Systems
• Authors of publication: Damián Fernández; M. Inés García-Seijo; Tamás Kégl; György Petöcz; László Kollár; M. Esther García-Fernández
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 4435 - 4443
• a: 10.275 ± 0.002 Å
• b: 10.63 ± 0.002 Å
• c: 20.77 ± 0.004 Å
• α: 80.244 ± 0.004°
• β: 86.006 ± 0.004°
• γ: 75.924 ± 0.004°
• Cell volume: 2167.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0463
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0672
• Weighted residual factors for all reflections included in the refinement: 0.0793
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No