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Information card for entry 7228415
Preview
| Coordinates | 7228415.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H18 O3 |
|---|---|
| Calculated formula | C19 H18 O3 |
| SMILES | O(C)c1c2c(c(c3ccc(OC)cc3)cc1OC)cccc2 |
| Title of publication | Metal triflate promoted synthesis of naphthalenes |
| Authors of publication | Chan, Chieh-Kai; Wang, Heui-Sin; Tsai, Yu-Lin; Chang, Meng-Yang |
| Journal of publication | RSC Adv. |
| Year of publication | 2017 |
| Journal volume | 7 |
| Journal issue | 47 |
| Pages of publication | 29321 |
| a | 13.345 ± 0.0012 Å |
| b | 15.2538 ± 0.0014 Å |
| c | 7.5723 ± 0.0007 Å |
| α | 90° |
| β | 99.819 ± 0.002° |
| γ | 90° |
| Cell volume | 1518.9 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 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 | 0.1172 |
| Residual factor for significantly intense reflections | 0.0504 |
| Weighted residual factors for significantly intense reflections | 0.1026 |
| Weighted residual factors for all reflections included in the refinement | 0.1285 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.996 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 197599 (current) | 2017-06-07 | cif/ Adding structures of 7228412, 7228413, 7228414, 7228415, 7228416, 7228417 via cif-deposit CGI script. |
7228415.cif |
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Users of the data should acknowledge the original authors of the
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