Information card for entry 1546328

Structure parameters

• Formula: C25 H23 N O2
• Calculated formula: C25 H23 N O2
• SMILES: N(=C1\OC(=CC1(c1ccccc1)c1ccccc1)c1cc(OC)ccc1)\CC
• Title of publication: Copper-Catalyzed Formal Carbene Migratory Insertion into Internal Olefinic C═C Bonds with N-Tosylhydrazones To Access Iminofuran and 2(3H)-Furanone Derivatives.
• Authors of publication: Huang, Fei; Liu, Zhuqing; Wang, Quannan; Lou, Jiang; Yu, Zhengkun
• Journal of publication: Organic letters
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 13
• Pages of publication: 3660 - 3663
• a: 8.9205 ± 0.0007 Å
• b: 9.2312 ± 0.0006 Å
• c: 24.273 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1998.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0544
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0821
• Weighted residual factors for all reflections included in the refinement: 0.0921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No