Information card for entry 4023809

Structure parameters

• Formula: C14 H24 N2 O2
• Calculated formula: C14 H24 N2 O2
• SMILES: O1C(=O)N([C@H]2CCCN3CCC[C@@H]23)[C@H](C1)C(C)C
• Title of publication: Asymmetric Synthesis of 8-Aminoindolizidine from Chiral 2-Pyrroleimines
• Authors of publication: Vincenzo Giulio Albano; Andrea Gualandi; Magda Monari; Diego Savoia
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2008
• Journal volume: 73
• Pages of publication: 8376 - 8381
• a: 5.859 ± 0.0004 Å
• b: 14.2547 ± 0.0009 Å
• c: 33.866 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2828.5 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• 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: 0.0493
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.1033
• Weighted residual factors for all reflections included in the refinement: 0.1098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No