Information card for entry 7239878

Structure parameters

• Formula: C20 H15 Cl O5
• Calculated formula: C20 H15 Cl O5
• Title of publication: Total synthesis of Palmarumycin BGs, C1 and Guignardin E
• Authors of publication: Liu, Xinlei; Li, Shuyi; Wei, Xinyu; Zhao, Yu; Lai, Daowan; Zhou, Ligang; Wang, Mingan
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 3
• Pages of publication: 1588 - 1594
• a: 8.7889 ± 0.0003 Å
• b: 10.1048 ± 0.0005 Å
• c: 8.8667 ± 0.0003 Å
• α: 90°
• β: 93.111 ± 0.003°
• γ: 90°
• Cell volume: 786.29 ± 0.05 ų
• Cell temperature: 114 ± 4 K
• Ambient diffraction temperature: 114 ± 4 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0394
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0975
• Weighted residual factors for all reflections included in the refinement: 0.099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No