Information card for entry 7008092

Structure parameters

• Formula: C31 H39 Al O2 S2
• Calculated formula: C31 H39 Al O2 S2
• SMILES: O1[Al]23([S](c4c1c(cc(c4)C)C(C)(C)C)Cc1c(C[S]3c3c(O2)c(cc(c3)C)C(C)(C)C)cccc1)C
• 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: 17.001 ± 0.002 Å
• b: 17.967 ± 0.002 Å
• c: 10.009 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3057.3 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Residual factor for all reflections: 0.0435
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.0899
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No