Information card for entry 1546215

Structure parameters

• Formula: C14 H15 N O3
• Calculated formula: C14 H15 N O3
• Title of publication: Synthesis of Functionalized Indenones via Rh-Catalyzed C-H Activation Cascade Reaction.
• Authors of publication: Lv, Ningning; Chen, Zhengkai; Liu, Yue; Liu, Zhanxiang; Zhang, Yuhong
• Journal of publication: Organic letters
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 10
• Pages of publication: 2588 - 2591
• a: 25.771 ± 0.003 Å
• b: 6.8258 ± 0.0008 Å
• c: 7.1894 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1264.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293.15 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.066
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.11
• Weighted residual factors for all reflections included in the refinement: 0.1235
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No