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Information card for entry 7037130
Preview
| Coordinates | 7037130.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C17 H24 Cu F6 N7 P2 |
|---|---|
| Calculated formula | C17 H24 Cu F6 N7 P2 |
| SMILES | [Cu]12([n]3n(P(n4[n]1c(cc4C)C)n1[n]2c(cc1C)C)c(cc3C)C)[N]#CC.[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | Tris(pyrazolyl)phosphines with copper(i): from monomers to polymers. |
| Authors of publication | Tazelaar, Cornelis G. J.; Nicolas, Emmanuel; van Dijk, Tom; Broere, Daniël L J; Cardol, Mitchel; Lutz, Martin; Gudat, Dietrich; Slootweg, J. Chris; Lammertsma, Koop |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2016 |
| Journal volume | 45 |
| Journal issue | 5 |
| Pages of publication | 2237 - 2249 |
| a | 26.0651 ± 0.0016 Å |
| b | 7.7824 ± 0.0003 Å |
| c | 25.9327 ± 0.0013 Å |
| α | 90° |
| β | 116.124 ± 0.003° |
| γ | 90° |
| Cell volume | 4723 ± 0.4 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0704 |
| Residual factor for significantly intense reflections | 0.0484 |
| Weighted residual factors for significantly intense reflections | 0.1198 |
| Weighted residual factors for all reflections included in the refinement | 0.1328 |
| 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 |
|---|---|---|---|
| 301849 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/03/ Each referenced PubChem compound corresponds to the full crystal structure. |
7037130.cif |
| 176061 | 2016-02-05 | cif/ Updating files of 7037130, 7037131, 7037132, 7037133, 7037134, 7037135 Original log message: Adding full bibliography for 7037130--7037135.cif. |
7037130.cif |
| 170234 | 2015-11-12 | cif/ Adding structures of 7037130, 7037131, 7037132, 7037133, 7037134, 7037135 via cif-deposit CGI script. |
7037130.cif |
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Users of the data should acknowledge the original authors of the
structural data.