Information card for entry 4023807

Structure parameters

• Formula: C14 H24 N2 O2
• Calculated formula: C14 H24 N2 O2
• SMILES: N12CCC[C@@H]2[C@@H](N2C(=O)OC[C@@H]2C(C)C)CCC1
• 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: 6.1635 ± 0.0007 Å
• b: 10.3337 ± 0.0011 Å
• c: 23.006 ± 0.003 Å
• α: 90°
• β: 97.226 ± 0.001°
• γ: 90°
• Cell volume: 1453.7 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0643
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.1008
• Weighted residual factors for all reflections included in the refinement: 0.1183
• Goodness-of-fit parameter for all reflections included in the refinement: 0.958
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No