Information card for entry 7038605

Structure parameters

• Formula: C40 H74 O4 P4 Pt6
• Calculated formula: C40 H74 O4 P4 Pt6
• SMILES: [P]1(C(C)(C)C)(C(C)(C)C)[Pt]23(C#C)[Pt]451(C#[O])[Pt]13([P]2(C(C)(C)C)C(C)(C)C)(C#[O])[Pt]234([P](C(C)(C)C)(C(C)(C)C)[Pt]42([P](C(C)(C)C)(C(C)(C)C)[Pt]5134C#[O])C#C)C#[O]
• Title of publication: Synthesis and characterization of non-bridging mono- and bis-σ-η(1)-alkynyl derivatives of the phosphido-bridged hexaplatinum core [Pt6(μ-PBu(t)2)4(CO)4](2.).
• Authors of publication: Bonuccelli, Veronica; Funaioli, Tiziana; Leoni, Piero; Marchetti, Fabio; Marchetti, Lorella; Pasquali, Marco
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 16
• Pages of publication: 6878 - 6892
• a: 17.3664 ± 0.0002 Å
• b: 17.3664 ± 0.0002 Å
• c: 17.6625 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5326.87 ± 0.11 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.0241
• Residual factor for significantly intense reflections: 0.0173
• Weighted residual factors for significantly intense reflections: 0.031
• Weighted residual factors for all reflections included in the refinement: 0.0323
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No