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Information card for entry 7160316
Preview
| Coordinates | 7160316.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H24 N2 Na2 O13 S2 |
|---|---|
| Calculated formula | C27 H24 N2 Na2 O13 S2 |
| Title of publication | ESIPT fluorescence turn-on sensors for detection of short chain inorganic polyphosphate in water. |
| Authors of publication | Roy, Subhra Kanti; Moser, Sandra; Dürr-Mayer, Tobias; Hinkelmann, Rahel; Jessen, Henning J. |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2025 |
| Journal volume | 23 |
| Journal issue | 6 |
| Pages of publication | 1373 - 1379 |
| a | 19.36 ± 0.006 Å |
| b | 8.134 ± 0.002 Å |
| c | 18.684 ± 0.005 Å |
| α | 90° |
| β | 92.357 ± 0.006° |
| γ | 90° |
| Cell volume | 2939.8 ± 1.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.043 |
| Residual factor for significantly intense reflections | 0.034 |
| Weighted residual factors for significantly intense reflections | 0.0819 |
| Weighted residual factors for all reflections included in the refinement | 0.0873 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299099 (current) | 2025-04-05 | cif/ Updating files of 7160315, 7160316 Original log message: Adding full bibliography for 7160315--7160316.cif. |
7160316.cif |
| 297022 | 2025-01-01 | cif/ Adding structures of 7160315, 7160316 via cif-deposit CGI script. |
7160316.cif |
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Users of the data should acknowledge the original authors of the
structural data.