Information card for entry 7017596

Structure parameters

• Formula: C33 H56 O9 Pt2 Ru2 Sn2
• Calculated formula: C33 H56 O9 Pt2 Ru2 Sn2
• SMILES: [Pt]1234([Pt]567([Ru]1([Ru]25(C#[O])(C#[O])(C#[O])([H]7)[H]4)(C#[O])(C#[O])(C6=O)C3=O)([Sn](C(C)(C)C)(C(C)(C)C)C(C)(C)C)C#[O])([Sn](C(C)(C)C)(C(C)(C)C)C(C)(C)C)C#[O]
• Title of publication: Ru(x)Pt(y)Sn(z) cluster-derived nanoparticle catalysts: spectroscopic investigation into the nature of active multinuclear single sites.
• Authors of publication: Manzoli, Maela; Shetti, Vasudev N.; Blaine, Jonathan A. L.; Zhu, Lei; Isrow, Derek; Yempally, Veeranna; Captain, Burjor; Coluccia, Salvatore; Raja, Robert; Gianotti, Enrica
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 3
• Pages of publication: 982 - 989
• a: 9.6022 ± 0.0004 Å
• b: 12.0461 ± 0.0005 Å
• c: 21.2192 ± 0.0008 Å
• α: 89.733 ± 0.001°
• β: 80.605 ± 0.001°
• γ: 73.446 ± 0.001°
• Cell volume: 2318.84 ± 0.16 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0404
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0637
• Weighted residual factors for all reflections included in the refinement: 0.0734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No