Information card for entry 4036329

Structure parameters

• Formula: C18 H18 N2
• Calculated formula: C18 H18 N2
• Title of publication: A [2 + 3] Reductive Cyclodimerization of Quinoline by SmI2.
• Authors of publication: Yella, Ramesh; Gottlieb, Hugo E.; Hoz, Shmaryahu
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2015
• Journal volume: 80
• Journal issue: 17
• Pages of publication: 8929 - 8932
• a: 26.293 ± 0.003 Å
• b: 26.293 ± 0.003 Å
• c: 10.119 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6058.3 ± 1.5 ų
• Cell temperature: 123 ± 1 K
• Ambient diffraction temperature: 123 ± 1 K
• Number of distinct elements: 3
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1227
• Residual factor for significantly intense reflections: 0.121
• Weighted residual factors for significantly intense reflections: 0.2358
• Weighted residual factors for all reflections included in the refinement: 0.2372
• Goodness-of-fit parameter for all reflections included in the refinement: 1.282
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No