Information card for entry 1546769

Structure parameters

• Formula: C40 H56 Co N3 O3
• Calculated formula: C40 H56 Co N3 O3
• SMILES: [Co]123(Oc4c(cc(cc4C=[N]2[C@@H]2CCCC[C@H]2[N]3=Cc2cc(cc(c2O1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(=O)NCC#C.[Co]123(Oc4c(cc(cc4C=[N]2[C@H]2CCCC[C@@H]2[N]3=Cc2cc(cc(c2O1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(=O)NCC#C
• Title of publication: Visible-light-induced synthesis of polymers with versatile end groups mediated by organocobalt complexes
• Authors of publication: Liu, Xu; Tian, Lei; Wu, Zhenqiang; Zhao, Xianyuan; Wang, Zikuan; Yu, Donggeng; Fu, Xuefeng
• Journal of publication: Polym. Chem.
• Year of publication: 2017
• a: 10.784 ± 0.003 Å
• b: 12.609 ± 0.004 Å
• c: 14.442 ± 0.002 Å
• α: 98.614 ± 0.005°
• β: 96.546 ± 0.003°
• γ: 105.985 ± 0.005°
• Cell volume: 1841.5 ± 0.8 ų
• Cell temperature: 173.15 K
• Ambient diffraction temperature: 173.15 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: 0.078
• Residual factor for significantly intense reflections: 0.0763
• Weighted residual factors for significantly intense reflections: 0.1735
• Weighted residual factors for all reflections included in the refinement: 0.1744
• Goodness-of-fit parameter for all reflections included in the refinement: 1.22
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No