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Information card for entry 1562364
Preview
| Coordinates | 1562364.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H15 N3 O |
|---|---|
| Calculated formula | C19 H15 N3 O |
| SMILES | N(=C\c1c(O)ccc(/N=N/c2ccccc2)c1)/c1ccccc1 |
| Title of publication | Orthorhombic Polymorphism of 4-(2-Phenyldiazenyl)-2-[(phenylimino)methyl]phenol |
| Authors of publication | SUDA, Shintaro; ONAMI, Yuika; HARAGUCHI, Tomoyuki; AKITSU, Takashiro |
| Journal of publication | X-ray Structure Analysis Online |
| Year of publication | 2021 |
| Journal volume | 37 |
| Journal issue | 0 |
| Pages of publication | 17 - 18 |
| a | 18.351 ± 0.004 Å |
| b | 17.574 ± 0.004 Å |
| c | 4.5721 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1474.5 ± 0.5 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 4 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.0882 |
| Residual factor for significantly intense reflections | 0.0757 |
| Weighted residual factors for significantly intense reflections | 0.2283 |
| Weighted residual factors for all reflections included in the refinement | 0.2379 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 264971 (current) | 2021-05-05 | cif/ Adding structures of 1562364 via cif-deposit CGI script. |
1562364.cif |
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