Information card for entry 4038837

Structure parameters

• Formula: C28 H27 N O3
• Calculated formula: C28 H27 N O3
• Title of publication: Biomimetically Inspired, One-Step Synthesis of Exotine A and Exotine B.
• Authors of publication: Lepovitz, Lance T.; Martin, Stephen F.
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2020
• a: 11.4662 ± 0.0015 Å
• b: 13.068 ± 0.002 Å
• c: 16.186 ± 0.002 Å
• α: 82.877 ± 0.009°
• β: 88.111 ± 0.009°
• γ: 79.015 ± 0.011°
• Cell volume: 2362.4 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.131
• Residual factor for significantly intense reflections: 0.0797
• Weighted residual factors for significantly intense reflections: 0.1745
• Weighted residual factors for all reflections included in the refinement: 0.2133
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No