Information card for entry 4519393

Structure parameters

• Formula: C59 H52 N8 O2 Zn2
• Calculated formula: C59 H52 N8 O2 Zn2
• Title of publication: Reversible On/Off Switching of Lactide Cyclopolymerization with a Redox-Active Formazanate Ligand
• Authors of publication: de Vries, Folkert; Otten, Edwin
• Journal of publication: ACS Catalysis
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 7
• Pages of publication: 4125 - 4130
• a: 9.1508 ± 0.0003 Å
• b: 10.8692 ± 0.0004 Å
• c: 14.2352 ± 0.0005 Å
• α: 80.73 ± 0.001°
• β: 73.248 ± 0.001°
• γ: 67.252 ± 0.001°
• Cell volume: 1248.34 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0283
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0672
• Weighted residual factors for all reflections included in the refinement: 0.0681
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No