Information card for entry 4070647

Structure parameters

• Formula: C49 H51 Cl P2 Pd2 Si
• Calculated formula: C49 H51 Cl P2 Pd2 Si
• SMILES: [Pd]123([Pd]4([Cl]1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[C]3(C2(C)C)=C4C#C[Si](CC)(CC)CC)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Mono- and Dipalladium Movement on the π-Conjugated Five-Carbon Chain
• Authors of publication: Takahashi, Yoshiteru; Tsutsumi, Ken; Nakagai, Yuzo; Morimoto, Tsumoru; Kakiuchi, Kiyomi; Ogoshi, Sensuke; Kurosawa, Hideo
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 2
• Pages of publication: 276
• a: 9.161 ± 0.004 Å
• b: 15.238 ± 0.006 Å
• c: 18.554 ± 0.009 Å
• α: 94.636 ± 0.018°
• β: 97.931 ± 0.018°
• γ: 91.766 ± 0.015°
• Cell volume: 2555 ± 2 ų
• Cell temperature: 296.1 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 significantly intense reflections: 0.0775
• Weighted residual factors for all reflections included in the refinement: 0.0652
• Goodness-of-fit parameter for all reflections included in the refinement: 0.943
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No