Information card for entry 7227416

Structure parameters

• Formula: C2 H3 K N2 O3
• Calculated formula: C2 H3 K N2 O3
• 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: 5.8792 ± 0.0007 Å
• b: 6.8542 ± 0.0008 Å
• c: 12.8207 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 516.64 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0222
• Residual factor for significantly intense reflections: 0.0215
• Weighted residual factors for significantly intense reflections: 0.0537
• Weighted residual factors for all reflections included in the refinement: 0.0539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No