Information card for entry 7157182

Structure parameters

• Formula: C25 H21 N O3
• Calculated formula: C25 H21 N O3
• Title of publication: Copper-catalyzed carbene/alkyne metathesis terminated with the Buchner reaction: synthesis of dihydrocyclohepta[b]indoles.
• Authors of publication: Zeng, Qian; Dong, Kuiyong; Huang, Jingjing; Qiu, Lihua; Xu, Xinfang
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2019
• Journal volume: 17
• Journal issue: 9
• Pages of publication: 2326 - 2330
• a: 11.065 Å
• b: 11.521 Å
• c: 15.832 Å
• α: 90°
• β: 97.78°
• γ: 90°
• Cell volume: 1999.68 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1476
• Residual factor for significantly intense reflections: 0.1073
• Weighted residual factors for significantly intense reflections: 0.1803
• Weighted residual factors for all reflections included in the refinement: 0.2016
• Goodness-of-fit parameter for all reflections included in the refinement: 1.185
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No