Information card for entry 1508550

Structure parameters

• Formula: C16 H36 Al Cl4 N
• Calculated formula: C16 H36 Al Cl4 N
• SMILES: Cl[Al](Cl)(Cl)[Cl-].[N+](CCCC)(CCCC)(CCCC)CCCC
• Title of publication: Structure Effects of Lewis Acids on the Living Cationic Polymerization ofp-Methoxystyrene: Distinct Difference in Polymerization Behavior from Vinyl Ethers
• Authors of publication: Kanazawa, Arihiro; Shibutani, Shota; Yoshinari, Nobuto; Konno, Takumi; Kanaoka, Shokyoku; Aoshima, Sadahito
• Journal of publication: Macromolecules
• Year of publication: 2012
• Journal volume: 45
• Journal issue: 19
• Pages of publication: 7749
• a: 18.2479 ± 0.0006 Å
• b: 11.5043 ± 0.0004 Å
• c: 11.3089 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2374.07 ± 0.13 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.0853
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.1496
• Weighted residual factors for all reflections included in the refinement: 0.1607
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No