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Information card for entry 7720999
Preview
| Coordinates | 7720999.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C53 H49 Cl3 N4 O P2 Ru |
|---|---|
| Calculated formula | C53 H49 Cl3 N4 O P2 Ru |
| Title of publication | Cooperative Ruthenium Catalyst for Deaminative Coupling of Primary Amines to Symmetrical Secondary Amines |
| Authors of publication | Bera, Jitendra K.; Yadav, Sudhir; Chourasia, Vishal; Ranjan, Prabodh; De, Subhabrata; Saptal, Vitthal Bhimrao |
| Journal of publication | Dalton Transactions |
| Year of publication | 2026 |
| a | 13.99 ± 0.002 Å |
| b | 20.087 ± 0.003 Å |
| c | 19.489 ± 0.003 Å |
| α | 90° |
| β | 102.038 ± 0.003° |
| γ | 90° |
| Cell volume | 5356.3 ± 1.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100.15 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0892 |
| Residual factor for significantly intense reflections | 0.0678 |
| Weighted residual factors for significantly intense reflections | 0.1675 |
| Weighted residual factors for all reflections included in the refinement | 0.1784 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 305893 (current) | 2026-05-07 | cif/ Adding structures of 7720996, 7720997, 7720998, 7720999 via cif-deposit CGI script. |
7720999.cif |
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Users of the data should acknowledge the original authors of the
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