Information card for entry 7120751

Structure parameters

• Formula: C26 H24 N2 O5
• Calculated formula: C26 H24 N2 O5
• SMILES: c1cccc2c1[C@@H](CC(=O)c1ccccc1)[C@H]([C@@H]2C(C)(C)c1ccc(cc1)N(=O)=O)N(=O)=O.c1cccc2c1[C@H](CC(=O)c1ccccc1)[C@@H]([C@H]2C(C)(C)c1ccc(cc1)N(=O)=O)N(=O)=O
• Title of publication: Synthesis of Indanes via Carbene-Catalyzed Single-Electron-Transfer Processes and Cascade Reactions
• Authors of publication: Wang, Yuhuang; WU, XINGXING; Chi, Yonggui Robin
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 13.234 ± 0.004 Å
• b: 11.14 ± 0.003 Å
• c: 15.953 ± 0.005 Å
• α: 90°
• β: 109.502 ± 0.009°
• γ: 90°
• Cell volume: 2217 ± 1.1 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1037
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1183
• Weighted residual factors for all reflections included in the refinement: 0.1451
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No