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Information card for entry 1540029
Preview
| Coordinates | 1540029.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | HPC3 |
|---|---|
| Formula | C28 H20 Cu O7 |
| Calculated formula | C28 H20 Cu O7 |
| Title of publication | A fluorosurfactant and photoreducible Cu(II)-tren click catalyst: surfactant and catalytic properties at liquid/liquid interfaces. |
| Authors of publication | Jochyms, Quentin; Guillot, Pierre; Mignard, Emmanuel; Vincent, Jean-Marc |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 45 |
| Pages of publication | 19700 - 19707 |
| a | 12.3691 ± 0.0011 Å |
| b | 13.9416 ± 0.0013 Å |
| c | 13.8663 ± 0.0013 Å |
| α | 90° |
| β | 100.45 ± 0.002° |
| γ | 90° |
| Cell volume | 2351.5 ± 0.4 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0337 |
| Residual factor for significantly intense reflections | 0.0268 |
| Weighted residual factors for significantly intense reflections | 0.071 |
| Weighted residual factors for all reflections included in the refinement | 0.0746 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301779 (current) | 2025-08-18 | Add cross-references to PubChem compounds in COD range 1/54 Each referenced PubChem compound corresponds to the full crystal structure. |
1540029.cif |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
1540029.cif |
| 171166 | 2015-12-09 | cif/ Updating files of 1540029 Original log message: Adding full bibliography for 1540029.cif. |
1540029.cif |
| 169165 | 2015-10-15 | cif/ Adding structures of 1540029 via cif-deposit CGI script. |
1540029.cif |
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Users of the data should acknowledge the original authors of the
structural data.