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Information card for entry 2312591
Preview
| Coordinates | 2312591.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | μ-Oxido-bis(μ-5-phenyltetrazolato-κ^2^<i>N</i>^2^:<i>N</i>^3^)\ bis[(dimethylamido)tris(5-phenyltetrazolato-κ<i>N</i>^2^)tantalum(V)] toluene 0.25-solvate |
|---|---|
| Formula | C65.75 H70 N36 O Ta2 |
| Calculated formula | C65.75 H70 N36 O Ta2 |
| Title of publication | Coordination variety of phenyltetrazolato and dimethylamido ligands in dimeric Ti, Zr, and Ta complexes. |
| Authors of publication | Bikzhanova, Galina A.; Guzei, Ilia A. |
| Journal of publication | Acta crystallographica. Section C, Structural chemistry |
| Year of publication | 2024 |
| Journal volume | 80 |
| Journal issue | 9 |
| a | 22.5131 ± 0.0008 Å |
| b | 25.5101 ± 0.0009 Å |
| c | 26.7165 ± 0.0009 Å |
| α | 90° |
| β | 101.383 ± 0.0004° |
| γ | 90° |
| Cell volume | 15041.8 ± 0.9 Å3 |
| Cell temperature | 105 K |
| Ambient diffraction temperature | 105.15 K |
| Number of distinct elements | 5 |
| 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 | 0.0371 |
| Residual factor for significantly intense reflections | 0.027 |
| Weighted residual factors for significantly intense reflections | 0.0634 |
| Weighted residual factors for all reflections included in the refinement | 0.0681 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 294213 (current) | 2024-08-24 | cif/ Adding structures of 2312589, 2312590, 2312591 via cif-deposit CGI script. |
2312591.cif |
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