Information card for entry 7018512

Structure parameters

• Formula: C64 H64 N4 Na4 O10
• Calculated formula: C64 H64 N4 Na4 O10
• SMILES: [Na]1234([O]56[Na]789([O](c%10c([N]8=Cc8c6cccc8)cccc%10)C)[O]68[Na]%105([O](c5c([N]9%10=Cc9c8cccc9)cccc5)C)([O]51[Na]186([O](c6c([N]1=Cc1c5cccc1)cccc6)C)[O]27c1ccccc1C=[N]48c1ccccc1[O]3C)[O]1CCCC1)[O]1CCCC1
• Title of publication: Synthesis, characterization and catalytic activity of lithium and sodium iminophenoxide complexes towards ring-opening polymerization of l-lactide.
• Authors of publication: Lu, Wei-Yi; Hsiao, Mon-Wei; Hsu, Sodio C. N.; Peng, Wei-Te; Chang, Ya-Ju; Tsou, Yu-Chi; Wu, Ting-Yi; Lai, Yi-Chun; Chen, Yun; Chen, Hsuan-Ying
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 13
• Pages of publication: 3659 - 3667
• a: 12.3496 ± 0.0002 Å
• b: 22.14 ± 0.0005 Å
• c: 24.1563 ± 0.0005 Å
• α: 94.865 ± 0.002°
• β: 98.374 ± 0.002°
• γ: 99.712 ± 0.002°
• Cell volume: 6400.1 ± 0.2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0776
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1781
• Weighted residual factors for all reflections included in the refinement: 0.1878
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No