Information card for entry 1542655

Structure parameters

• Formula: C24 H26 N4 O4
• Calculated formula: C24 H26 N4 O4
• SMILES: O(C(=O)N1[C@@H](N2N([C@@]31c1ccccc1N(C3=O)C)C(=O)CC2)c1ccccc1)C(C)(C)C.O(C(=O)N1[C@H](N2N([C@]31c1ccccc1N(C3=O)C)C(=O)CC2)c1ccccc1)C(C)(C)C
• Title of publication: Diastereoselective 1,3-Dipolar Cycloadditions of N,N'-Cyclic Azomethine Imines with Iminooxindoles for Access to Oxindole Spiro-N,N-bicyclic Heterocycles.
• Authors of publication: Zhao, Hong-Wu; Li, Bo; Pang, Hai-Liang; Tian, Ting; Chen, Xiao-Qin; Song, Xiu-Qing; Meng, Wei; Yang, Zhao; Zhao, Yu-Di; Liu, Yue-Yang
• Journal of publication: Organic letters
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 4
• Pages of publication: 848 - 851
• a: 9.715 ± 0.003 Å
• b: 10.003 ± 0.003 Å
• c: 13.038 ± 0.003 Å
• α: 105.483 ± 0.005°
• β: 98.771 ± 0.002°
• γ: 111.44 ± 0.004°
• Cell volume: 1091.5 ± 0.5 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0558
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1084
• Weighted residual factors for all reflections included in the refinement: 0.1123
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No