Information card for entry 7027898

Structure parameters

• Formula: C58 H70 Cl4 P8 Pt
• Calculated formula: C58 H70 Cl4 P8 Pt
• SMILES: [Pt]1(P2P3C4(P5C3(P3C2(P(P14)C53C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)Cl.C(Cl)Cl
• Title of publication: Facile insertion and halogen migration reactions of the hexaphosphapentaprismane cage P6C4tBu4 with zerovalent and divalent platinum complexes
• Authors of publication: Al-Ktaifani, Mahmoud M.; Hitchcock, Peter B.; Nixon, John F.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 9
• Pages of publication: 1132 - 1135
• a: 14.4626 ± 0.0005 Å
• b: 14.538 ± 0.0005 Å
• c: 16.4301 ± 0.0004 Å
• α: 109.342 ± 0.002°
• β: 90.658 ± 0.002°
• γ: 112.736 ± 0.002°
• Cell volume: 2967.41 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0593
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.1146
• Weighted residual factors for all reflections included in the refinement: 0.1219
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No