Information card for entry 4086608

Structure parameters

• Formula: C40 H76 P2 Pt Ru2
• Calculated formula: C40 H76 P2 Pt Ru2
• SMILES: CC(C)(C)[P]1([Pt]234([Ru]56789([c]%10([c]5([c]6([c]7([c]9%10C)C)C)C)C)([CH2]=[CH2]8)([H]2)[P]3(C(C)(C)C)C(C)(C)C)[H][Ru]2356714([CH2]=[CH2]2)[c]1([c]3([c]5([c]6([c]71C)C)C)C)C)C(C)(C)C
• Title of publication: Synthesis of a Heterometallic Trinuclear Cluster of Ruthenium and Platinum with a Linear Alignment
• Authors of publication: Kuzutani, Takuya; Torihata, Yushi; Suzuki, Hiroharu; Takao, Toshiro
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 15
• Pages of publication: 2543
• a: 8.6625 ± 0.0005 Å
• b: 10.8809 ± 0.0007 Å
• c: 12.8072 ± 0.0009 Å
• α: 68.185 ± 0.002°
• β: 75.376 ± 0.002°
• γ: 68.479 ± 0.002°
• Cell volume: 1033.1 ± 0.12 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0291
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0613
• Weighted residual factors for all reflections included in the refinement: 0.0627
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No