Information card for entry 7160847

Structure parameters

• Formula: C13 H12 Cl2 O5
• Calculated formula: C13 H12 Cl2 O5
• Title of publication: Resorcylic acid lactone derivatives with immunosuppressive activity from the endophytic <i>Podospora</i> sp. G214.
• Authors of publication: Li, Wanpeng; Gao, Ying; Ruan, Hanli
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 47
• Pages of publication: 10771 - 10778
• a: 9.4456 ± 0.0005 Å
• b: 6.665 ± 0.0003 Å
• c: 10.5231 ± 0.0005 Å
• α: 90°
• β: 99.933 ± 0.005°
• γ: 90°
• Cell volume: 652.55 ± 0.06 ų
• Cell temperature: 99.99 ± 0.1 K
• Ambient diffraction temperature: 99.99 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0993
• Residual factor for significantly intense reflections: 0.0981
• Weighted residual factors for significantly intense reflections: 0.2145
• Weighted residual factors for all reflections included in the refinement: 0.2149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.206
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No