Information card for entry 1516709

Structure parameters

• Formula: C30 H22 O2
• Calculated formula: C30 H22 O2
• SMILES: c1(OC)cc2c(cc3c4ccccc4c4ccccc4c3c2cc1OC)c1ccccc1
• Title of publication: Lewis Acid Catalyzed Cascade Reaction to Carbazoles and Naphthalenes via Dehydrative [3 + 3]-Annulation.
• Authors of publication: Wang, Shaoyin; Chai, Zhuo; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Wang, Shaowu
• Journal of publication: Organic letters
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 13
• Pages of publication: 3592 - 3595
• a: 7.5251 ± 0.0005 Å
• b: 13.3225 ± 0.0009 Å
• c: 21.8161 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2187.1 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0442
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.083
• Weighted residual factors for all reflections included in the refinement: 0.0877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No