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Information card for entry 1553354
Preview
Coordinates | 1553354.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H24 O2 |
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Calculated formula | C15 H24 O2 |
SMILES | O=C1/C=C/C(C/C=C(/CC[C@H](O)[C@@H]1C)C)(C)C |
Title of publication | Bioactive Sesquiterpenoids from the Peeled Stems of Syringa pinnatifolia. |
Authors of publication | Zhang, Ruifei; Feng, Xiao; Su, Guozhu; Mu, Zejing; Zhang, Hexinge; Zhao, Yanan; Jiao, Shungang; Cao, Lan; Chen, Suyile; Tu, Pengfei; Chai, Xingyun |
Journal of publication | Journal of natural products |
Year of publication | 2018 |
Journal volume | 81 |
Journal issue | 8 |
Pages of publication | 1711 - 1720 |
a | 6.0342 ± 0.0004 Å |
b | 12.8921 ± 0.0008 Å |
c | 17.5406 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1364.54 ± 0.15 Å3 |
Cell temperature | 107.4 K |
Ambient diffraction temperature | 107.4 K |
Number of distinct elements | 3 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0381 |
Residual factor for significantly intense reflections | 0.0371 |
Weighted residual factors for significantly intense reflections | 0.0972 |
Weighted residual factors for all reflections included in the refinement | 0.0984 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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