Information card for entry 4071911

Structure parameters

• Formula: C61 H78 Ge O7 Os3 P2 Pt
• Calculated formula: C61 H78 Ge O7 Os3 P2 Pt
• SMILES: [Pt]123([Os]456([Os]781([Os]192([P]7(C(C)(C)C)C(C)(C)C)([CH]48[C]51(=[CH]39)C)(C#[O])C#[O])(C#[O])(C#[O])[H]6)([Ge](c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])C#[O])([P](C(C)(C)C)(C(C)(C)C)C(C)(C)C)C#[O].c1ccccc1.c1ccccc1
• Title of publication: Activation of Hydrogen and Related Small Molecules by the Unsaturated Cluster Complex PtOs3(CO)7(PBut3)(μ-PBut2)(μ4-CHCMeCH)
• Authors of publication: Adams, Richard D.; Boswell, Erin M.; Hall, Michael B.; Yang, Xinzheng
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 19
• Pages of publication: 4938
• a: 17.5041 ± 0.001 Å
• b: 19.0187 ± 0.0011 Å
• c: 19.5406 ± 0.0011 Å
• α: 90°
• β: 102.623 ± 0.001°
• γ: 90°
• Cell volume: 6347.9 ± 0.6 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0709
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1259
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No