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Information card for entry 1512196
Preview
Coordinates | 1512196.cif |
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Original paper (by DOI) | HTML |
Formula | C23 H30 N3 O9 |
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Calculated formula | C23 H30 N3 O9 |
Title of publication | Overcoming Synthetic Challenges of Oridonin A-Ring Structural Diversification: Regio- and Stereoselective Installation of Azides and 1,2,3-Triazoles at the C-1, C-2, or C-3 Position |
Authors of publication | Ding, Chunyong; Zhang, Yusong; Chen, Haijun; Wild, Christopher; Wang, Tianzhi; White, Mark A.; Shen, Qiang; Zhou, Jia |
Journal of publication | Organic Letters |
Year of publication | 2013 |
Journal volume | 15 |
Journal issue | 14 |
Pages of publication | 3718 |
a | 15.3838 ± 0.0003 Å |
b | 14.0397 ± 0.0004 Å |
c | 10.9931 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2374.33 ± 0.1 Å3 |
Cell temperature | 263 K |
Ambient diffraction temperature | 263 K |
Number of distinct elements | 4 |
Space group number | 18 |
Hermann-Mauguin space group symbol | P 21 21 2 |
Hall space group symbol | P 2 2ab |
Residual factor for all reflections | 0.0609 |
Residual factor for significantly intense reflections | 0.0547 |
Weighted residual factors for all reflections | 0.1559 |
Weighted residual factors for significantly intense reflections | 0.1539 |
Weighted residual factors for all reflections included in the refinement | 0.1559 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.1331 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
1512196.cif |
87911 | 2013-08-27 | cif/ Adding structures of 1512196 via cif-deposit CGI script. |
1512196.cif |
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Users of the data should acknowledge the original authors of the
structural data.