Information card for entry 7022918

Structure parameters

• Formula: C30 H30 Al2 N2 O2
• Calculated formula: C30 H30 Al2 N2 O2
• SMILES: C[Al]1(C)[N](=Cc2c(c(c3c4c(ccc3)C=[N]([Al](C)(C)O4)c3ccccc3)ccc2)O1)c1ccccc1
• Title of publication: Synthesis of binuclear phenoxyimino organoaluminum complexes and their use as the catalyst precursors for efficient ring-opening polymerisation of ε-caprolactone.
• Authors of publication: Han, Hong-Ling; Liu, Yan; Liu, Jing-Yu; Nomura, Kotohiro; Li, Yue-Sheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 34
• Pages of publication: 12346 - 12353
• a: 10.4697 ± 0.0007 Å
• b: 18.1726 ± 0.0012 Å
• c: 14.8982 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2834.6 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0735
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.1188
• Weighted residual factors for all reflections included in the refinement: 0.1347
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No