Information card for entry 7026170

Structure parameters

• Formula: C35 H63 N3 O2 Si2 Zn
• Calculated formula: C35 H63 N3 O2 Si2 Zn
• SMILES: [Zn]12([N](Cc3c(c(cc(c3)C)C(C)(C)C)O2)(Cc2c(c(cc(c2)C)C(C)(C)C)OC)CC[N]1(C)C)N([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Zinc complexes supported by multidentate aminophenolate ligands: synthesis, structure and catalysis in ring-opening polymerization of rac-lactide.
• Authors of publication: Wang, Liying; Ma, Haiyan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 34
• Pages of publication: 7897 - 7910
• a: 8.925 ± 0.001 Å
• b: 24.604 ± 0.003 Å
• c: 18.129 ± 0.002 Å
• α: 90°
• β: 95.663 ± 0.002°
• γ: 90°
• Cell volume: 3961.5 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.096
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.1155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No