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Information card for entry 7042577
Preview
| Coordinates | 7042577.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C62 H54 Ag B F4 N2 P4 S2 |
|---|---|
| Calculated formula | C62 H54 Ag B F4 N2 P4 S2 |
| SMILES | c1(ccccc1)[P]1(c2ccccc2)N(c2ccc(cc2)SC)[P](c2ccccc2)(c2ccccc2)[Ag]21[P](c1ccccc1)(c1ccccc1)N(c1ccc(cc1)SC)[P]2(c1ccccc1)c1ccccc1.[B](F)(F)(F)[F-] |
| Title of publication | Mono- and polynuclear Ag(i) complexes of N-functionalized bis(diphenylphosphino)amine DPPA-type ligands: synthesis, solid-state structures and reactivity. |
| Authors of publication | Ghisolfi, Alessio; Fliedel, Christophe; de Frémont, Pierre; Braunstein, Pierre |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2017 |
| Journal volume | 46 |
| Journal issue | 17 |
| Pages of publication | 5571 - 5586 |
| a | 11.947 ± 0.0002 Å |
| b | 11.947 ± 0.0002 Å |
| c | 41.0063 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5852.86 ± 0.17 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 78 |
| Hermann-Mauguin space group symbol | P 43 |
| Hall space group symbol | P 4cw |
| Residual factor for all reflections | 0.1258 |
| Residual factor for significantly intense reflections | 0.0571 |
| Weighted residual factors for significantly intense reflections | 0.125 |
| Weighted residual factors for all reflections included in the refinement | 0.1688 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301850 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/04/ Each referenced PubChem compound corresponds to the full crystal structure. |
7042577.cif |
| 196408 | 2017-05-06 | cif/ Updating files of 7042575, 7042576, 7042577, 7042578, 7042579, 7042580, 7042581 Original log message: Adding full bibliography for 7042575--7042581.cif. |
7042577.cif |
| 194441 | 2017-03-23 | cif/ Adding structures of 7042575, 7042576, 7042577, 7042578, 7042579, 7042580, 7042581 via cif-deposit CGI script. |
7042577.cif |
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