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Information card for entry 3000255
Preview
| Coordinates | 3000255.cif |
|---|---|
| Structure factors | 3000255.hkl |
| Original paper (by DOI) | HTML |
| Formula | C63 H90 La2 N42 O27 |
|---|---|
| Calculated formula | C63 H90 La2 N42 O27 |
| Title of publication | Lanthanide(III) Based Complexes Containing 5,7-Dimethyl-1,2,4-triazolo[1,5-a ]pyrimidine as Long-Lived Photoluminescent Antiparasitic Agents |
| Authors of publication | Esteban-Parra, Ginés M.; Moscoso, Inmaculada; Cepeda, Javier; García, Jose A.; Sánchez-Moreno, Manuel; Rodríguez-Diéguez, Antonio; Quirós, Miguel |
| Journal of publication | European Journal of Inorganic Chemistry |
| Year of publication | 2020 |
| Journal volume | 2020 |
| Journal issue | 3 |
| Pages of publication | 308 |
| a | 16.4089 ± 0.0012 Å |
| b | 16.4089 ± 0.0012 Å |
| c | 19.4155 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 4527.3 ± 0.6 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 176 |
| Hermann-Mauguin space group symbol | P 63/m |
| Hall space group symbol | -P 6c |
| Residual factor for all reflections | 0.0297 |
| Residual factor for significantly intense reflections | 0.0278 |
| Weighted residual factors for significantly intense reflections | 0.0747 |
| Weighted residual factors for all reflections included in the refinement | 0.076 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.095 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 247120 (current) | 2020-01-23 | cif/ hkl/ Updating files of 3000255 Original log message: Releasing structure 3000255 into public domain as published material. |
3000255.cif 3000255.hkl |
| 215552 | 2019-05-27 | cif/ hkl/ Adding structures of 3000255 via cif-deposit CGI script. |
3000255.cif |
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Users of the data should acknowledge the original authors of the
structural data.