Information card for entry 4086610

Structure parameters

• Formula: C48 H80 P2 Pt Ru2 Si
• Calculated formula: C48 H80 P2 Pt Ru2 Si
• SMILES: [Pt]123([H][Ru]24567([H]3)([PH](C(C)(C)C)C(C)(C)C)[c]2([c]6([c]5([c]4([c]27C)C)C)C)C)[Si](c2ccccc2)(c2ccccc2)[RuH]2345([P]1(C(C)(C)C)C(C)(C)C)[c]1([c]2([c]5([c]4([c]31C)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: 11.9109 ± 0.0003 Å
• b: 22.567 ± 0.0006 Å
• c: 18.4174 ± 0.0005 Å
• α: 90°
• β: 101.286 ± 0.0009°
• γ: 90°
• Cell volume: 4854.7 ± 0.2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.025
• Residual factor for significantly intense reflections: 0.0212
• Weighted residual factors for significantly intense reflections: 0.0435
• Weighted residual factors for all reflections included in the refinement: 0.0446
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No