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Information card for entry 4127443
Preview
| Coordinates | 4127443.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H41 N3 |
|---|---|
| Calculated formula | C36 H41 N3 |
| Title of publication | Organic Redox Systems Based on Pyridinium-Carbene Hybrids. |
| Authors of publication | Antoni, Patrick W.; Bruckhoff, Tim; Hansmann, Max M. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2019 |
| Journal volume | 141 |
| Journal issue | 24 |
| Pages of publication | 9701 - 9711 |
| a | 22.9103 ± 0.0012 Å |
| b | 16.2048 ± 0.0008 Å |
| c | 8.2525 ± 0.0005 Å |
| α | 90° |
| β | 92.611 ± 0.002° |
| γ | 90° |
| Cell volume | 3060.6 ± 0.3 Å3 |
| Cell temperature | 99.97 K |
| Ambient diffraction temperature | 99.97 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.044 |
| Residual factor for significantly intense reflections | 0.0407 |
| Weighted residual factors for significantly intense reflections | 0.1093 |
| Weighted residual factors for all reflections included in the refinement | 0.112 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 220716 (current) | 2019-11-02 | cif/ Adding structures of 4127443 via cif-deposit CGI script. |
4127443.cif |
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Users of the data should acknowledge the original authors of the
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