Information card for entry 4105470

Structure parameters

• Formula: C66 H108 Cu4 Si2
• Calculated formula: C66 H108 Cu4 Si2
• SMILES: [c]12(c3c(cc4c1C(CC4(CC)CC)(CC)CC)C(CC3(CC)CC)(CC)CC)[Cu]134[Cu]52[C]2#[C]([Si](C)(C)C)[Cu]652[c]2(c5c(cc7c2C(CC7(CC)CC)(CC)CC)C(CC5(CC)CC)(CC)CC)[Cu]46[C]1#[C]3[Si](C)(C)C
• Title of publication: Isolated Monomeric and Dimeric Mixed Diorganocuprates Based on the Size-Controllable Bulky "Rind" Ligands
• Authors of publication: Mikinao Ito; Daisuke Hashizume; Takeo Fukunaga; Tsukasa Matsuo; Kohei Tamao
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 18024 - 18025
• a: 10.5552 ± 0.0018 Å
• b: 11.339 ± 0.002 Å
• c: 15.234 ± 0.003 Å
• α: 83.017 ± 0.007°
• β: 73.241 ± 0.006°
• γ: 70.01 ± 0.006°
• Cell volume: 1640.1 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0428
• Residual factor for significantly intense reflections: 0.0331
• Weighted residual factors for significantly intense reflections: 0.0816
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No