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Information card for entry 1571251
Preview
| Coordinates | 1571251.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 6,6',6'',6'''-(phosphinine-2,3,5,6-tetrayl)tetrakis(3-methylpyridine) toluene solvate |
|---|---|
| Formula | C36 H33 N4 P |
| Calculated formula | C36 H33 N4 P |
| Title of publication | Highly selective, reversible water activation by P,N-cooperativity in pyridyl-functionalized phosphinines. |
| Authors of publication | Kopp, Richard O.; Kleynemeyer, Sabrina L.; Groth, Lucie J.; Ernst, Moritz J.; Rupf, Susanne M.; Weber, Manuela; Kershaw Cook, Laurence J.; Coles, Nathan T.; Neale, Samuel E.; Müller, Christian |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 15 |
| Pages of publication | 5496 - 5506 |
| a | 6.0439 ± 0.0002 Å |
| b | 10.8817 ± 0.0005 Å |
| c | 11.4035 ± 0.0005 Å |
| α | 102.992 ± 0.002° |
| β | 95.821 ± 0.001° |
| γ | 93.214 ± 0.001° |
| Cell volume | 724.61 ± 0.05 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0782 |
| Residual factor for significantly intense reflections | 0.0735 |
| Weighted residual factors for significantly intense reflections | 0.1536 |
| Weighted residual factors for all reflections included in the refinement | 0.1556 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.277 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291581 (current) | 2024-05-05 | cif/ Updating files of 1571249, 1571250, 1571251, 1571252, 1571253, 1571254 Original log message: Adding full bibliography for 1571249--1571254.cif. |
1571251.cif |
| 290503 | 2024-03-15 | cif/ Adding structures of 1571249, 1571250, 1571251, 1571252, 1571253, 1571254 via cif-deposit CGI script. |
1571251.cif |
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Users of the data should acknowledge the original authors of the
structural data.