Information card for entry 4065016

Structure parameters

• Formula: C25 H46 Al2 Cl8 Cr N S2 Si2
• Calculated formula: C25 H46 Al2 Cl8 Cr N S2 Si2
• SMILES: [Cr]12(N([Si](C[S]1C1CCCCC1)(C)C)[Si](C)(C)C[S]2C1CCCCC1)([Cl][Al](Cl)(Cl)Cl)[Cl][Al](Cl)(Cl)Cl.c1(ccccc1)C
• Title of publication: Ethylene Oligomerization Promoted by a Silylated-SNS Chromium System
• Authors of publication: Albahily, Khalid; Gambarotta, Sandro; Duchateau, Robbert
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 17
• Pages of publication: 4655
• a: 11.0381 ± 0.0013 Å
• b: 11.9963 ± 0.0014 Å
• c: 31.581 ± 0.004 Å
• α: 90°
• β: 93.935 ± 0.002°
• γ: 90°
• Cell volume: 4172 ± 0.9 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0947
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.1541
• Weighted residual factors for all reflections included in the refinement: 0.171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No