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Information card for entry 7241057
Preview
| Coordinates | 7241057.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | Acridine+Chloroacetate |
|---|---|
| Chemical name | 9 |
| Formula | C15 H12 Cl N O2 |
| Calculated formula | C15 H12 Cl N O2 |
| SMILES | [nH+]1c2ccccc2cc2ccccc12.ClCC(=O)[O-] |
| Title of publication | Fluorescence enhancement of quinolines by protonation |
| Authors of publication | Tervola, Essi; Truong, Khai-Nghi; Ward, Jas S.; Priimagi, Arri; Rissanen, Kari |
| Journal of publication | RSC Advances |
| Year of publication | 2020 |
| Journal volume | 10 |
| Journal issue | 49 |
| Pages of publication | 29385 - 29393 |
| a | 7.2478 ± 0.0004 Å |
| b | 8.8083 ± 0.0003 Å |
| c | 11.5321 ± 0.0006 Å |
| α | 69.55 ± 0.001° |
| β | 73.313 ± 0.002° |
| γ | 67.418 ± 0.001° |
| Cell volume | 626.9 ± 0.05 Å3 |
| Cell temperature | 170 ± 2 K |
| Ambient diffraction temperature | 170 ± 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 | 0.0699 |
| Residual factor for significantly intense reflections | 0.0503 |
| Weighted residual factors for significantly intense reflections | 0.116 |
| Weighted residual factors for all reflections included in the refinement | 0.1265 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301870 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/24/ Each referenced PubChem compound corresponds to the full crystal structure. |
7241057.cif |
| 258123 | 2020-10-06 | cif/ Updating files of 7241053, 7241054, 7241055, 7241056, 7241057, 7241058, 7241059, 7241060, 7241061, 7241062, 7241063, 7241064, 7241065, 7241066 Original log message: Adding full bibliography for 7241053--7241066.cif. |
7241057.cif |
| 255293 | 2020-08-13 | cif/ Adding structures of 7241053, 7241054, 7241055, 7241056, 7241057, 7241058, 7241059, 7241060, 7241061, 7241062, 7241063, 7241064, 7241065, 7241066 via cif-deposit CGI script. |
7241057.cif |
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Users of the data should acknowledge the original authors of the
structural data.