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Information card for entry 1557211
Preview
| Coordinates | 1557211.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Bis[2-(benzylamino)-4-methylpyridinato]trichlorotantalum(V) |
|---|---|
| Formula | C26 H26 Cl3 N4 Ta |
| Calculated formula | C26 Cl3 N4 Ta |
| SMILES | c12cc(cc[n]1[Ta]1(N2Cc2ccccc2)(Cl)(Cl)([n]2c(cc(cc2)C)N1Cc1ccccc1)Cl)C |
| Title of publication | Syntheses and Crystal Structures of Bis[2-(benzylamino)-4-methylpyridinato]trichlorotantalum(V) and Bis[2-(benzylamino)-6-methylpyridinato]trichlorotantalum(V) |
| Authors of publication | Polamo, Mika; Leskela, Markku |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1997 |
| Journal volume | 51 |
| Pages of publication | 709 - 713 |
| a | 10.577 ± 0.007 Å |
| b | 23.018 ± 0.011 Å |
| c | 11.102 ± 0.004 Å |
| α | 90° |
| β | 93.35 ± 0.04° |
| γ | 90° |
| Cell volume | 2698 ± 2 Å3 |
| Ambient diffraction temperature | 193 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for significantly intense reflections | 0.0282 |
| Weighted residual factors for significantly intense reflections | 0.0747 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.101 |
| 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 |
|---|---|---|---|
| 247457 (current) | 2020-02-03 | cif/ Adding structures of 1557211 via cif-deposit CGI script. |
1557211.cif |
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