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Information card for entry 7030905
Preview
| Coordinates | 7030905.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C37 H48 Cl N3 P2 Ti |
|---|---|
| Calculated formula | C37 H48 Cl N3 P2 Ti |
| SMILES | C1=P(c2ccccc2)(c2ccccc2)N(C(C)(C)C)[Ti]([N](C(C)(C)C)=P1(c1ccccc1)c1ccccc1)(=NC(C)(C)C)Cl |
| Title of publication | Titanium imido complexes stabilised by bis(iminophosphoranyl)methanide ligands: the influence of N-substituents on solution dynamics and reactivity. |
| Authors of publication | Normand, Adrien T.; Massard, Alexandre; Richard, Philippe; Canovas, Coline; Balan, Cédric; Picquet, Michel; Auffrant, Audrey; Le Gendre, Pierre |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2014 |
| Journal volume | 43 |
| Journal issue | 40 |
| Pages of publication | 15098 - 15110 |
| a | 10.6873 ± 0.0002 Å |
| b | 10.9883 ± 0.0003 Å |
| c | 18.1781 ± 0.0004 Å |
| α | 86.435 ± 0.001° |
| β | 86.02 ± 0.001° |
| γ | 65.267 ± 0.001° |
| Cell volume | 1932.95 ± 0.08 Å3 |
| Cell temperature | 115 K |
| Ambient diffraction temperature | 115 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0459 |
| Residual factor for significantly intense reflections | 0.0405 |
| Weighted residual factors for significantly intense reflections | 0.1137 |
| Weighted residual factors for all reflections included in the refinement | 0.1177 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180015 (current) | 2016-03-25 | cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/09. |
7030905.cif |
| 124848 | 2014-10-06 | cif/ Updating files of 7030902, 7030903, 7030904, 7030905 Original log message: Adding full bibliography for 7030902--7030905.cif. |
7030905.cif |
| 113779 | 2014-05-14 | cif/ Adding structures of 7030902, 7030903, 7030904, 7030905 via cif-deposit CGI script. |
7030905.cif |
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