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Information card for entry 1571619
Preview
| Coordinates | 1571619.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C35 H51 B10 N2 Ta |
|---|---|
| Calculated formula | C35 H51 B10 N2 Ta |
| Title of publication | Metallaaromaticity involving a d<sup>0</sup> early transition metal centre: synthesis, structure, and aromaticity of tantallapyridinazirine complexes. |
| Authors of publication | Yang, Jingting; Xu, Xin; Lin, Zhenyang; Xie, Zuowei |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 21 |
| Pages of publication | 7943 - 7948 |
| a | 11.5786 ± 0.0008 Å |
| b | 12.9866 ± 0.001 Å |
| c | 26.895 ± 0.002 Å |
| α | 90° |
| β | 97.57 ± 0.002° |
| γ | 90° |
| Cell volume | 4008.9 ± 0.5 Å3 |
| Cell temperature | 284 ± 2 K |
| Ambient diffraction temperature | 284 ± 2 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 | 0.0273 |
| Residual factor for significantly intense reflections | 0.0232 |
| Weighted residual factors for significantly intense reflections | 0.0525 |
| Weighted residual factors for all reflections included in the refinement | 0.0542 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 292932 (current) | 2024-07-05 | cif/ Updating files of 1571618, 1571619, 1571620 Original log message: Adding full bibliography for 1571618--1571620.cif. |
1571619.cif |
| 291844 | 2024-05-15 | cif/ Adding structures of 1571618, 1571619, 1571620 via cif-deposit CGI script. |
1571619.cif |
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Users of the data should acknowledge the original authors of the
structural data.