Information card for entry 1572416

Structure parameters

• Formula: C36 H50 Cl2 Cu N6
• Calculated formula: C36 H50 Cl2 Cu N6
• Title of publication: Visible light photoflow synthesis of a Cu(ii) single-chain polymer nanoparticle catalyst
• Authors of publication: Gillhuber, Sebastian; Holloway, Joshua O.; Mundsinger, Kai; Kammerer, Jochen A.; Harmer, Jeffrey R.; Frisch, Hendrik; Barner-Kowollik, Christopher; Roesky, Peter W.
• Journal of publication: Chemical Science
• Year of publication: 2024
• a: 14.4097 ± 0.0015 Å
• b: 5.8858 ± 0.0007 Å
• c: 21.876 ± 0.003 Å
• α: 90°
• β: 92.905 ± 0.009°
• γ: 90°
• Cell volume: 1853 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0976
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for significantly intense reflections: 0.11
• Weighted residual factors for all reflections included in the refinement: 0.1297
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No