Information card for entry 7006243

Structure parameters

• Formula: C68 H108 Li4 N4 O4
• Calculated formula: C68 H108 Li4 N4 O4
• SMILES: [Li]123[O]4[Li]5[O]1(c1c(cc(cc1C[N]2(Cc1cc(cc(c41)C(C)(C)C)C(C)(C)C)CC[N]3(C)C)C(C)(C)C)C(C)(C)C)[Li]1[O]52[Li]34[O]1c1c(cc(cc1C(C)(C)C)C(C)(C)C)C[N]3(Cc1c2c(cc(c1)C(C)(C)C)C(C)(C)C)CC[N]4(C)C
• Title of publication: Lithium complexes supported by amine bis-phenolate ligands as efficient catalysts for ring-opening polymerization of L-lactide.
• Authors of publication: Huang, Chi-An; Chen, Chi-Tien
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 47
• Pages of publication: 5561 - 5566
• a: 10.9896 ± 0.0007 Å
• b: 32.351 ± 0.002 Å
• c: 19.9026 ± 0.0014 Å
• α: 90°
• β: 95.376 ± 0.002°
• γ: 90°
• Cell volume: 7044.7 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1639
• Residual factor for significantly intense reflections: 0.0649
• Weighted residual factors for significantly intense reflections: 0.1635
• Weighted residual factors for all reflections included in the refinement: 0.2059
• Goodness-of-fit parameter for all reflections included in the refinement: 0.916
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No