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Information card for entry 7123011
Preview
| Coordinates | 7123011.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C68 H94 K2 N10 O2 Ti2 |
|---|---|
| Calculated formula | C68 H94 K2 N10 O2 Ti2 |
| Title of publication | Conversion of dinitrogen to tris(trimethylsilyl)amine catalyzed by titanium triamido-amine complexes |
| Authors of publication | Okuda, Jun; Spaniol, Thomas Paul; Kögerler, Paul; Ghana, Priyabrata; van Kruechten, Franziska D.; van Leusen, Jan |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 11.9665 ± 0.0004 Å |
| b | 13.959 ± 0.0005 Å |
| c | 19.5766 ± 0.0006 Å |
| α | 90° |
| β | 92.472 ± 0.003° |
| γ | 90° |
| Cell volume | 3267.04 ± 0.19 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100.15 K |
| Number of distinct elements | 6 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0881 |
| Residual factor for significantly intense reflections | 0.0544 |
| Weighted residual factors for significantly intense reflections | 0.1181 |
| Weighted residual factors for all reflections included in the refinement | 0.1315 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.96 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213708 (current) | 2019-02-20 | cif/ Adding structures of 7123010, 7123011 via cif-deposit CGI script. |
7123011.cif |
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