Information card for entry 1556380

Structure parameters

• Formula: C35 H47 N3 O Zn
• Calculated formula: C35 H47 N3 O Zn
• SMILES: [Zn]12(N(C(=CC(=[N]1Cc1[n]2cccc1)C)C)c1c(cccc1C(C)C)C(C)C)Oc1c(cccc1C(C)C)C(C)C
• Title of publication: Synthesis and structures of tridentate β-diketiminato zinc phenoxides as catalysts for immortal ring-opening polymerization of l-lactide
• Authors of publication: Dai, Zhongran; Zhang, Jinjin; Gao, Yuan; Tang, Ning; Huang, Yong; Wu, Jincai
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 12
• Pages of publication: 3268
• a: 10.889 ± 0.0005 Å
• b: 14.2911 ± 0.0007 Å
• c: 20.7227 ± 0.0009 Å
• α: 92.804 ± 0.004°
• β: 92.129 ± 0.004°
• γ: 92.212 ± 0.004°
• Cell volume: 3216.1 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.115
• Residual factor for significantly intense reflections: 0.0655
• Weighted residual factors for significantly intense reflections: 0.0986
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No