Information card for entry 1562005

Structure parameters

• Formula: C24 H30 N2 O
• Calculated formula: C24 H30 N2 O
• SMILES: O=C1[C@@](N(C)[C@H](N1C)C(C)(C)C)(C(=C\c1ccccc1)\C)c1ccccc1
• Title of publication: Asymmetric hydroalkylation of alkynes and allenes with imidazolidinone derivatives: α-alkenylation of α-amino acids
• Authors of publication: Panahi, Farhad; Khosravi, Hormoz; Bauer, Felix; Breit, Bernhard
• Journal of publication: Chemical Science
• Year of publication: 2021
• Journal volume: 12
• Journal issue: 21
• Pages of publication: 7388 - 7392
• a: 9.138 ± 0.0011 Å
• b: 13.8136 ± 0.0018 Å
• c: 15.8299 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1998.2 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0609
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.0917
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No