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Information card for entry 7048526
Preview
| Coordinates | 7048526.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H30 B Cl F4 N2 Ni P2 |
|---|---|
| Calculated formula | C30 H30 B Cl F4 N2 Ni P2 |
| Title of publication | Facile synthesis of Pd(ii) and Ni(ii) pincer carbene complexes by the double C-H bond activation of a new hexahydropyrimidine-based bis(phosphine): catalysis of C-N couplings. |
| Authors of publication | Subramaniyan, Vasudevan; Dutta, Bidisa; Govindaraj, Anbarasu; Mani, Ganesan |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 21 |
| Pages of publication | 7203 - 7210 |
| a | 8.974 ± 0.003 Å |
| b | 12.154 ± 0.003 Å |
| c | 15.103 ± 0.004 Å |
| α | 95.04 ± 0.018° |
| β | 106.082 ± 0.018° |
| γ | 103.084 ± 0.017° |
| Cell volume | 1521.6 ± 0.8 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 297.75 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1295 |
| Residual factor for significantly intense reflections | 0.071 |
| Weighted residual factors for significantly intense reflections | 0.1477 |
| Weighted residual factors for all reflections included in the refinement | 0.176 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 224456 (current) | 2019-11-08 | cif/ Updating files of 7048523, 7048524, 7048525, 7048526 Original log message: Adding full bibliography for 7048523--7048526.cif. |
7048526.cif |
| 212958 | 2019-01-11 | cif/ Adding structures of 7048523, 7048524, 7048525, 7048526 via cif-deposit CGI script. |
7048526.cif |
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Users of the data should acknowledge the original authors of the
structural data.