Information card for entry 4345489

Structure parameters

• Formula: C64 H76 N2 O18 P2 Pt9
• Calculated formula: C64 H76 N2 O18 P2 Pt9
• SMILES: [Pt]123([Pt]4([Pt]1(C4=O)(C#[O])C3=O)(C2=O)C#[O])[P](CC[P]([Pt]123[Pt]4([Pt]1(C4=O)(C#[O])C3=O)(C2=O)C#[O])(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[Pt]123([Pt]4([Pt]1(C4=O)(C#[O])C3=O)(C2=O)C#[O])C#[O].[N+](CC)(CC)(CC)CC.[N+](CC)(CC)(CC)CC.CC(=O)C.CC(=O)C
• Title of publication: Heteroleptic Chini-Type Platinum Clusters: Synthesis and Characterization of Bis-Phospine Derivatives of [Pt3n(CO)6n](2-) (n = 2-4).
• Authors of publication: Cesari, Cristiana; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Mancini, Federica; Zacchini, Stefano
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 3
• Pages of publication: 1655 - 1668
• a: 29.341 ± 0.006 Å
• b: 14.916 ± 0.003 Å
• c: 17.883 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7827 ± 3 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0644
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0765
• Weighted residual factors for all reflections included in the refinement: 0.085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No