Information card for entry 1564141

Structure parameters

• Formula: C104 H106 N10 Pt5
• Calculated formula: C104 H106 N10 Pt5
• SMILES: [Pt]123([Pt]4567([Pt]81([Pt]14([Pt]58(C6=Nc4c(cccc4C)C)(C1=Nc1c(cccc1C)C)C#[N]c1c(cccc1C)C)(C7=Nc1c(cccc1C)C)C#[N]c1c(cccc1C)C)(C3=Nc1c(cccc1C)C)C#[N]c1c(cccc1C)C)(C2=Nc1c(cccc1C)C)C#[N]c1c(cccc1C)C)C#[N]c1c(cccc1C)C.c1(ccccc1)C.c1(ccccc1)C
• Title of publication: Further insights into platinum carbonyl Chini clusters
• Authors of publication: Berti, Beatrice; Bortoluzzi, Marco; Ceriotti, Alessandro; Cesari, Cristiana; Femoni, Cristina; Carmela Iapalucci, Maria; Zacchini, Stefano
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 512
• Pages of publication: 119904
• a: 22.6369 ± 0.0017 Å
• b: 14.3468 ± 0.001 Å
• c: 28.33 ± 0.002 Å
• α: 90°
• β: 98.264 ± 0.003°
• γ: 90°
• Cell volume: 9105.1 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0678
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.1394
• Weighted residual factors for all reflections included in the refinement: 0.144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.24
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No