Information card for entry 4118708

Structure parameters

• Formula: C15 H24 N2 O
• Calculated formula: C15 H24 N2 O
• SMILES: N1=N([C@H]2[C@@H](C1=O)[C@@H]1CC[C@H]2C1)=C(C(C)C)C(C)C.N1=N([C@@H]2[C@H](C1=O)[C@H]1CC[C@@H]2C1)=C(C(C)C)C(C)C
• Title of publication: A Tunable Route for the Synthesis of Azomethine Imines and β-Aminocarbonyl Compounds from Alkenes
• Authors of publication: Christian Clavette; Wei Gan; Amanda Bongers; Thomas Markiewicz; Amy B. Toderian; Serge I. Gorelsky; André M. Beauchemin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 16111 - 16114
• a: 12.8722 ± 0.0002 Å
• b: 9.6885 ± 0.0001 Å
• c: 11.3846 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1419.8 ± 0.03 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.0895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No