Information card for entry 4517553

Structure parameters

• Formula: C42.65 H53 Ag Cl5.29 I N6 O8.35 S
• Calculated formula: C42.649 H53 Ag Cl5.298 I N6 O8.351 S
• Title of publication: Silver(II) and Silver(III) Intermediates in Alkene Aziridination with a Dinuclear Silver(I) Nitrene Transfer Catalyst
• Authors of publication: Elkoush, Tasneem; Mak, Choi L.; Paley, Daniel W.; Campbell, Michael G.
• Journal of publication: ACS Catalysis
• Year of publication: 2020
• Pages of publication: 4820
• a: 12.4359 ± 0.0013 Å
• b: 16.0865 ± 0.0007 Å
• c: 26.638 ± 0.002 Å
• α: 90°
• β: 98.824 ± 0.009°
• γ: 90°
• Cell volume: 5265.9 ± 0.7 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 8
• 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: 0.1196
• Residual factor for significantly intense reflections: 0.1086
• Weighted residual factors for significantly intense reflections: 0.2771
• Weighted residual factors for all reflections included in the refinement: 0.2854
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.41328 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No