Information card for entry 7227419

Structure parameters

• Formula: C41 H35 N2 O5 P2 Re
• Calculated formula: C41 H35 N2 O5 P2 Re
• Title of publication: Lewis Acid stabilization and Activation of Primary N-Nitrosamides
• Authors of publication: Chua, Zhijie; Rosadiuk, Kris; Perepichka, Inna; Bohle, Scott
• Journal of publication: RSC Adv.
• Year of publication: 2017
• a: 11.2939 ± 0.001 Å
• b: 22.8887 ± 0.0019 Å
• c: 17.8433 ± 0.0011 Å
• α: 90°
• β: 128.455 ± 0.004°
• γ: 90°
• Cell volume: 3612.1 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0411
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0572
• Weighted residual factors for all reflections included in the refinement: 0.0617
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No