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Information card for entry 1550174
Preview
| Coordinates | 1550174.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C33 H33 N3 O2 |
|---|---|
| Calculated formula | C33 H33 N3 O2 |
| SMILES | N(c1c(cc2C3(N(Cc4ccccc4)C(=O)c4c3cccc4)c3cc(c(NCC)cc3Oc2c1)C)C)CC |
| Title of publication | A differentially selective probe for trivalent chemosensor upon single excitation with cell imaging application: potential applications in combinatorial logic circuit and memory devices. |
| Authors of publication | Das, Dipankar; Alam, Rabiul; Katarkar, Atul; Ali, Mahammad |
| Journal of publication | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology |
| Year of publication | 2019 |
| Journal volume | 18 |
| Journal issue | 1 |
| Pages of publication | 242 - 252 |
| a | 9.0397 ± 0.0008 Å |
| b | 12.5823 ± 0.0011 Å |
| c | 12.8196 ± 0.0011 Å |
| α | 86.214 ± 0.002° |
| β | 73.428 ± 0.002° |
| γ | 72.357 ± 0.002° |
| Cell volume | 1331.5 ± 0.2 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273 ± 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 | 0.0684 |
| Residual factor for significantly intense reflections | 0.0527 |
| Weighted residual factors for significantly intense reflections | 0.1388 |
| Weighted residual factors for all reflections included in the refinement | 0.1522 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301780 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 1/55 Each referenced PubChem compound corresponds to the full crystal structure. |
1550174.cif |
| 225316 | 2019-11-08 | cif/ Updating files of 1550174 Original log message: Adding full bibliography for 1550174.cif. |
1550174.cif |
| 211765 | 2018-11-02 | cif/ Adding structures of 1550174 via cif-deposit CGI script. |
1550174.cif |
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Users of the data should acknowledge the original authors of the
structural data.