Information card for entry 4065018

Structure parameters

• Formula: C23 H53 Al2 Cl2 Cr N S2 Si2
• Calculated formula: C23 H53 Al2 Cl2 Cr N S2 Si2
• SMILES: [Cr]123([Cl][Al]([N]1([Si](C[S]2C1CCCCC1)(C)C)[Si](C[S]3C1CCCCC1)(C)C)(C)C)[Cl][Al](C)(C)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: 9.383 ± 0.002 Å
• b: 19.572 ± 0.004 Å
• c: 20.136 ± 0.004 Å
• α: 102.87 ± 0.004°
• β: 100.293 ± 0.004°
• γ: 102.156 ± 0.004°
• Cell volume: 3424 ± 1.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1106
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for significantly intense reflections: 0.1223
• Weighted residual factors for all reflections included in the refinement: 0.1405
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No