Information card for entry 7008094

Structure parameters

• Formula: C43 H47 Al O3 S2
• Calculated formula: C43 H47 Al O3 S2
• SMILES: [S]12[Al]3([S](CC2)c2c(O3)c(cc(c2)C)C(C)(C)C)(Oc2c1cc(cc2C(C)(C)C)C)OC(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Aluminium alkyl complexes supported by [OSSO] type bisphenolato ligands: synthesis, characterization and living polymerization of rac-lactide.
• Authors of publication: Ma, Haiyan; Melillo, Gianluca; Oliva, Leone; Spaniol, Thomas P.; Englert, Ulli; Okuda, Jun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 4
• Pages of publication: 721 - 727
• a: 14.766 ± 0.007 Å
• b: 11.823 ± 0.006 Å
• c: 22.17 ± 0.01 Å
• α: 90°
• β: 103.26 ± 0.01°
• γ: 90°
• Cell volume: 3767 ± 3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1477
• Residual factor for significantly intense reflections: 0.0763
• Weighted residual factors for significantly intense reflections: 0.1693
• Weighted residual factors for all reflections included in the refinement: 0.2104
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No