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Information card for entry 7058319
Preview
| Coordinates | 7058319.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C22 H23 N3 O2 |
|---|---|
| Calculated formula | C22 H23 N3 O2 |
| Title of publication | A viscochromic, mechanochromic, and unsymmetrical azine for selective detection of Al3+ and Cu2+ ions and its mitotracking studies |
| Authors of publication | Yadav, Richa; Rai, Abhishek; Sonkar, Avinash Kumar; Rai, Vipin; Gupta, Subash Chandra; Mishra, Lallan |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2019 |
| Journal volume | 43 |
| Journal issue | 18 |
| Pages of publication | 7109 |
| a | 5.7302 ± 0.0006 Å |
| b | 11.9227 ± 0.0013 Å |
| c | 14.2404 ± 0.0015 Å |
| α | 105.609 ± 0.003° |
| β | 96.095 ± 0.004° |
| γ | 100.244 ± 0.004° |
| Cell volume | 909.82 ± 0.17 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1164 |
| Residual factor for significantly intense reflections | 0.0649 |
| Weighted residual factors for significantly intense reflections | 0.1402 |
| Weighted residual factors for all reflections included in the refinement | 0.1725 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301851 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/05/ Each referenced PubChem compound corresponds to the full crystal structure. |
7058319.cif |
| 224919 | 2019-11-08 | cif/ Updating files of 7058319 Original log message: Adding full bibliography for 7058319.cif. |
7058319.cif |
| 214738 | 2019-04-24 | cif/ Adding structures of 7058319 via cif-deposit CGI script. |
7058319.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
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.
Users of the data should acknowledge the original authors of the
structural data.