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Information card for entry 1543976
Preview
Coordinates | 1543976.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H38 O11 |
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Calculated formula | C30 H38 O11 |
SMILES | OC.C1(=O)[C@](C(=O)C([C@H]([C@H](C(=O)OC)OC(=O)C)[C@@H]1C)(C)C)(CC1=CCC[C@@]2(C1=CC(=O)O[C@H]2c1ccoc1)C)O |
Title of publication | Thaixylomolins O–R: four new limonoids from the Trang mangrove, Xylocarpus moluccensis |
Authors of publication | Dai, Yi-Guo; Li, Wan-Shan; Pedpradab, Patchara; Liu, Jun-Jun; Wu, Jun; Shen, Li |
Journal of publication | RSC Advances |
Year of publication | 2016 |
Journal volume | 6 |
Journal issue | 89 |
Pages of publication | 85978 - 85984 |
a | 12.4747 ± 0.0003 Å |
b | 8.9839 ± 0.0001 Å |
c | 13.2402 ± 0.0003 Å |
α | 90° |
β | 107.131 ± 0.002° |
γ | 90° |
Cell volume | 1418.02 ± 0.05 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 3 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0695 |
Residual factor for significantly intense reflections | 0.0637 |
Weighted residual factors for significantly intense reflections | 0.18 |
Weighted residual factors for all reflections included in the refinement | 0.1888 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
Diffraction radiation wavelength | 1.54178 Å |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1543976.html
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