Information card for entry 7117366

Structure parameters

• Formula: C24 H24 N2 O7
• Calculated formula: C24 H24 N2 O7
• SMILES: O(C(C)(C)C)C(=O)N1C(=O)[C@]2(N(C(=O)OCc3ccccc3)[C@@H]2C(=O)OC)c2c1cccc2.O(C(C)(C)C)C(=O)N1C(=O)[C@@]2(N(C(=O)OCc3ccccc3)[C@H]2C(=O)OC)c2c1cccc2
• Title of publication: An unprecedented base-promoted domino reaction of methyleneindolinones and N-tosyloxycarbamates for the construction of bispirooxindoles and spiroaziridine oxindoles
• Authors of publication: Qi-Lin Wang; Tian Cai; Jing Zhou; Fang Tian; Xiao-Ying Xu; Li-Xin Wang
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 10726
• a: 6.647 ± 0.008 Å
• b: 12.469 ± 0.015 Å
• c: 14.173 ± 0.016 Å
• α: 87.147 ± 0.015°
• β: 79.429 ± 0.016°
• γ: 89.31 ± 0.015°
• Cell volume: 1153 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.2708
• Residual factor for significantly intense reflections: 0.1679
• Weighted residual factors for significantly intense reflections: 0.4117
• Weighted residual factors for all reflections included in the refinement: 0.4605
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No