Information card for entry 4080380

Structure parameters

• Formula: C40 H43 In N2 O Si
• Calculated formula: C40 H43 In N2 O Si
• SMILES: [In]1(C)(C)[N](=Cc2c(O1)c(cc(c2)C)[Si](c1ccccc1)(c1ccccc1)c1ccccc1)C1CCN(CC1)Cc1ccccc1
• 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: 10.512 ± 0.0005 Å
• b: 16.1052 ± 0.0007 Å
• c: 21.2943 ± 0.0007 Å
• α: 80.836 ± 0.001°
• β: 88.792 ± 0.001°
• γ: 80.585 ± 0.001°
• Cell volume: 3511.1 ± 0.3 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: 0.0392
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0637
• Weighted residual factors for all reflections included in the refinement: 0.068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No