Information card for entry 4133505

Structure parameters

• Formula: C26 H27 N3 O7 S
• Calculated formula: C26 H27 N3 O7 S
• Title of publication: Stereospecific Alkene Aziridination Using a Bifunctional Amino-Reagent: An Aza-Prilezhaev Reaction.
• Authors of publication: Farndon, Joshua J.; Young, Tom A.; Bower, John F.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 51
• Pages of publication: 17846 - 17850
• a: 9.7778 ± 0.0003 Å
• b: 10.9762 ± 0.0003 Å
• c: 23.229 ± 0.0006 Å
• α: 90°
• β: 93.747 ± 0.002°
• γ: 90°
• Cell volume: 2487.68 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0531
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0842
• Weighted residual factors for all reflections included in the refinement: 0.0913
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No