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Information card for entry 7157058
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Coordinates | 7157058.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Emerone B |
---|---|
Formula | C21 H30 O7 |
Calculated formula | C9.77778 H13.3333 O3.11111 |
Title of publication | Emerones A-C: three novel merosesquiterpenoids with unprecedented skeletons from Emericella sp. XL029. |
Authors of publication | Chen, Heng-Ye; Liu, Ting-Kai; Yang, Jian; Yang, Xiao-Long |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2019 |
Journal volume | 17 |
Journal issue | 36 |
Pages of publication | 8450 - 8455 |
a | 7.68291 ± 0.00011 Å |
b | 12.60214 ± 0.00017 Å |
c | 21.2697 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2059.36 ± 0.05 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 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 | 0.0336 |
Residual factor for significantly intense reflections | 0.0329 |
Weighted residual factors for significantly intense reflections | 0.0839 |
Weighted residual factors for all reflections included in the refinement | 0.0848 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7157058.html
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