Information card for entry 4028524

Structure parameters

• Formula: C24 H24 N2 O4
• Calculated formula: C24 H24 N2 O4
• SMILES: C1(=O)[C@]2(c3cc(C)ccc3N1)C[C@@](C)([C@@]1(C(=O)Nc3c1cc(C)cc3)[C@H]2C(=O)C)O.C1(=O)[C@@]2(c3cc(C)ccc3N1)C[C@](C)([C@]1(C(=O)Nc3c1cc(C)cc3)[C@@H]2C(=O)C)O
• Title of publication: Construction of Dispirocyclopentanebisoxindoles via Self-Domino Michael-Aldol Reactions of 3-Phenacylideneoxindoles
• Authors of publication: Jing Sun; Ya-Jing Xie; Chao-Guo Yan
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2013
• Journal volume: 78
• Pages of publication: 8354 - 8365
• a: 11.308 ± 0.002 Å
• b: 11.459 ± 0.002 Å
• c: 12.459 ± 0.002 Å
• α: 69.744 ± 0.002°
• β: 88.758 ± 0.003°
• γ: 81.088 ± 0.003°
• Cell volume: 1495.4 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1591
• Residual factor for significantly intense reflections: 0.1082
• Weighted residual factors for significantly intense reflections: 0.3381
• Weighted residual factors for all reflections included in the refinement: 0.3683
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No