Information card for entry 1556555

Structure parameters

• Formula: C51 H100 N6 Pd4 Si3
• Calculated formula: C51 H100 N6 Pd4 Si3
• SMILES: [Pd]12([Pd]3456[Pd]([Si]14(C(C)C)C(C)C)([Si]5([Pd]3([Si]26(C(C)C)C(C)C)=C1N(C(=C(N1C(C)C)C)C)C(C)C)(C(C)C)C(C)C)=C1N(C(=C(N1C(C)C)C)C)C(C)C)=C1N(C(=C(N1C(C)C)C)C)C(C)C
• Title of publication: Construction of a Planar Tetrapalladium Cluster by the Reaction of Palladium(0) Bis(isocyanide) with Cyclic Tetrasilane
• Authors of publication: Sunada, Y.; Taniyama, N.; Shimamoto, K.; Kyushin, S.; Nagashima, H.
• Journal of publication: Inorganics
• Year of publication: 2017
• Journal volume: 5
• Pages of publication: 84
• a: 14.505 ± 0.003 Å
• b: 15.339 ± 0.004 Å
• c: 15.655 ± 0.004 Å
• α: 89.593 ± 0.012°
• β: 63.724 ± 0.006°
• γ: 81.301 ± 0.011°
• Cell volume: 3080.2 ± 1.3 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 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: 0.0585
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.1016
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No