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Information card for entry 7060034
Preview
| Coordinates | 7060034.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C24 H23 N3 O4 S |
|---|---|
| Calculated formula | C24 H23 N3 O4 S |
| Title of publication | A highly sensitive and selective fluorescent turn-on chemosensor bearing a 7-diethylaminocoumarin moiety for the detection of cyanide in organic and aqueous solutions |
| Authors of publication | Aydıner, Burcu; Şahin, Ömer; Çakmaz, Deniz; Kaplan, Gökhan; Kaya, Kerem; Özdemir, Ümmühan Özmen; Seferoğlu, Nurgül; Seferoğlu, Zeynel |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2020 |
| Journal volume | 44 |
| Journal issue | 44 |
| Pages of publication | 19155 - 19165 |
| a | 8.0871 ± 0.0005 Å |
| b | 8.3785 ± 0.0005 Å |
| c | 16.9875 ± 0.001 Å |
| α | 98.318 ± 0.003° |
| β | 91.468 ± 0.003° |
| γ | 105.343 ± 0.003° |
| Cell volume | 1095.87 ± 0.12 Å3 |
| Cell temperature | 305 ± 2 K |
| Ambient diffraction temperature | 305.2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0548 |
| Residual factor for significantly intense reflections | 0.0391 |
| Weighted residual factors for significantly intense reflections | 0.0969 |
| Weighted residual factors for all reflections included in the refinement | 0.1079 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301852 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/06/ Each referenced PubChem compound corresponds to the full crystal structure. |
7060034.cif |
| 259609 | 2020-12-06 | cif/ Updating files of 7060034, 7060035, 7060036 Original log message: Adding full bibliography for 7060034--7060036.cif. |
7060034.cif |
| 258308 | 2020-10-11 | cif/ Adding structures of 7060034, 7060035, 7060036 via cif-deposit CGI script. |
7060034.cif |
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Users of the data should acknowledge the original authors of the
structural data.