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Information card for entry 7719463
Preview
| Coordinates | 7719463.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H22 Br2 N6 Pd |
|---|---|
| Calculated formula | C20 H22 Br2 N6 Pd |
| Title of publication | Synthesis of Pd(II)-NHC complexes <i>via</i> C-H oxidative addition of triazolium salts to Pd(0). |
| Authors of publication | Kovacevic, Anes; Parkin, Sean; Baltisberger, Jay H. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2025 |
| a | 10.124 ± 0.002 Å |
| b | 9.3713 ± 0.0019 Å |
| c | 11.796 ± 0.002 Å |
| α | 90° |
| β | 104.53 ± 0.03° |
| γ | 90° |
| Cell volume | 1083.4 ± 0.4 Å3 |
| Cell temperature | 100 ± 0.2 K |
| Ambient diffraction temperature | 100 ± 0.2 K |
| Number of distinct elements | 5 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | I 1 2 1 |
| Hall space group symbol | I 2y |
| Residual factor for all reflections | 0.0178 |
| Residual factor for significantly intense reflections | 0.0155 |
| Weighted residual factors for significantly intense reflections | 0.0392 |
| Weighted residual factors for all reflections included in the refinement | 0.0401 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302162 (current) | 2025-09-17 | cif/ Adding structures of 7719463, 7719464, 7719465 via cif-deposit CGI script. |
7719463.cif |
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Users of the data should acknowledge the original authors of the
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