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Information card for entry 1557167
Preview
| Coordinates | 1557167.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [Nb(BzNPy)2Cl3] |
|---|---|
| Formula | C24 H22 Cl3 N4 Nb |
| Calculated formula | C31 Cl3 N4 Nb |
| SMILES | [Nb]12(Cl)(Cl)(Cl)([n]3c(N1Cc1ccccc1)cccc3)[n]1c(N2Cc2ccccc2)cccc1.c1(ccccc1)C |
| Title of publication | Syntheses and Crystal Structures of Bis[2-(benzylamido)pyridine]trichloro Complexes of Niobium(V) and Tantalum(V) |
| Authors of publication | Polamo, Mika; Leskela, Markku |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1997 |
| Journal volume | 51 |
| Pages of publication | 449 - 454 |
| a | 18.292 ± 0.008 Å |
| b | 19.904 ± 0.015 Å |
| c | 17.646 ± 0.01 Å |
| α | 90° |
| β | 109.47 ± 0.04° |
| γ | 90° |
| Cell volume | 6057 ± 6 Å3 |
| Ambient diffraction temperature | 193 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1078 |
| Residual factor for significantly intense reflections | 0.0887 |
| Weighted residual factors for significantly intense reflections | 0.2283 |
| Weighted residual factors for all reflections included in the refinement | 0.2448 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 247284 (current) | 2020-01-28 | cif/ Adding structures of 1557167 via cif-deposit CGI script. |
1557167.cif |
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Users of the data should acknowledge the original authors of the
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