Information card for entry 7132149

Structure parameters

• Formula: C27 H22 N2 O
• Calculated formula: C27 H22 N2 O
• Title of publication: Ag(I)-Catalyzed Dearomatizing Spirocyclization/Nucleophile Addition Cascade Reactions of Indole-tethered Ynones
• Authors of publication: Bag, Debojyoti; Sawant, Sanghapal D.
• Journal of publication: Chemical Communications
• Year of publication: 2023
• a: 37.641 ± 0.003 Å
• b: 7.1425 ± 0.0006 Å
• c: 15.2538 ± 0.0012 Å
• α: 90°
• β: 99.978 ± 0.003°
• γ: 90°
• Cell volume: 4039 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0857
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1229
• Weighted residual factors for all reflections included in the refinement: 0.1374
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No