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Information card for entry 4513889
Preview
| Coordinates | 4513889.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H26 Cl N3 Si |
|---|---|
| Calculated formula | C13 H26 Cl N3 Si |
| Title of publication | Implications of CO2Activation by Frustrated Lewis Pairs in the Catalytic Hydroboration of CO2: A View Using N/Si+Frustrated Lewis Pairs |
| Authors of publication | von Wolff, N.; Lefèvre, G.; Berthet, J.-C.; Thuéry, P.; Cantat, T. |
| Journal of publication | ACS Catalysis |
| Year of publication | 2016 |
| Pages of publication | 4526 |
| a | 9.2603 ± 0.0004 Å |
| b | 12.2644 ± 0.0009 Å |
| c | 14.0949 ± 0.001 Å |
| α | 90° |
| β | 101.148 ± 0.004° |
| γ | 90° |
| Cell volume | 1570.58 ± 0.18 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.046 |
| Residual factor for significantly intense reflections | 0.0383 |
| Weighted residual factors for significantly intense reflections | 0.103 |
| Weighted residual factors for all reflections included in the refinement | 0.1081 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 183482 (current) | 2016-06-16 | cif/ Adding structures of 4513888, 4513889, 4513890, 4513891, 4513892, 4513893, 4513894 via cif-deposit CGI script. |
4513889.cif |
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Users of the data should acknowledge the original authors of the
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