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Information card for entry 7158135
Preview
Coordinates | 7158135.cif |
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Original paper (by DOI) | HTML |
Formula | C11.92 H13.91 O4 |
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Calculated formula | C12 H13.976 O4 |
Title of publication | Structures and absolute configurations of phomalones from the coral-associated fungus Parengyodontium album sp. SCSIO 40430. |
Authors of publication | Wang, Lu; Huang, Yanbing; Zhang, Liping; Liu, Zhiwen; Liu, Wei; Xu, Huixin; Zhang, Qingbo; Zhang, Haibo; Yan, Yan; Liu, Zhiyong; Zhang, Tianyu; Zhang, Wenjun; Zhang, Changsheng |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2021 |
Journal volume | 19 |
Journal issue | 27 |
Pages of publication | 6030 - 6037 |
a | 5.1015 ± 0.0003 Å |
b | 21.7906 ± 0.0018 Å |
c | 10.1611 ± 0.0004 Å |
α | 90° |
β | 102.619 ± 0.005° |
γ | 90° |
Cell volume | 1102.27 ± 0.12 Å3 |
Cell temperature | 99.9 ± 0.6 K |
Ambient diffraction temperature | 99.9 ± 0.6 K |
Number of distinct elements | 3 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0666 |
Residual factor for significantly intense reflections | 0.0575 |
Weighted residual factors for significantly intense reflections | 0.1707 |
Weighted residual factors for all reflections included in the refinement | 0.1771 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.101 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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