Information card for entry 4080377

Structure parameters

• Formula: C34 H33 Al N2 O Si
• Calculated formula: C34 H33 Al N2 O Si
• SMILES: [Al]12(C)(C)[n]3ccccc3C[N]1=Cc1cc(cc(c1O2)[Si](c1ccccc1)(c1ccccc1)c1ccccc1)C
• Title of publication: {Phenoxy-imine}aluminum versus -indium Complexes for the Immortal ROP of Lactide: Different Stereocontrol, Different Mechanisms
• Authors of publication: Normand, Mickael; Dorcet, Vincent; Kirillov, Evgeny; Carpentier, Jean-François
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 6
• Pages of publication: 1694
• a: 12.457 ± 0.004 Å
• b: 12.815 ± 0.004 Å
• c: 19.042 ± 0.007 Å
• α: 88.399 ± 0.012°
• β: 85.994 ± 0.012°
• γ: 76.229 ± 0.012°
• Cell volume: 2945 ± 1.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.164
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for significantly intense reflections: 0.1137
• Weighted residual factors for all reflections included in the refinement: 0.1519
• Goodness-of-fit parameter for all reflections included in the refinement: 0.951
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No