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Information card for entry 4132582
Preview
| Coordinates | 4132582.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C55 H83 Co K2 N O2 |
|---|---|
| Calculated formula | C55 H82.754 Co K2 N O2 |
| Title of publication | A Highly-Reduced Cobalt Terminal Carbyne: Divergent Metal- and α-Carbon-Centered Reactivity. |
| Authors of publication | Mokhtarzadeh, Charles C.; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2018 |
| Journal volume | 140 |
| Journal issue | 26 |
| Pages of publication | 8100 - 8104 |
| a | 46.323 ± 0.002 Å |
| b | 12.1188 ± 0.0005 Å |
| c | 24.6506 ± 0.001 Å |
| α | 90° |
| β | 121.309 ± 0.002° |
| γ | 90° |
| Cell volume | 11823.2 ± 0.9 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0854 |
| Residual factor for significantly intense reflections | 0.0489 |
| Weighted residual factors for significantly intense reflections | 0.0999 |
| Weighted residual factors for all reflections included in the refinement | 0.1122 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Diffraction radiation X-ray symbol | K-L~3~ |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 242530 (current) | 2019-11-26 | cif/ Adding structures of 4132582, 4132583, 4132584, 4132585, 4132586 via cif-deposit CGI script. |
4132582.cif |
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Users of the data should acknowledge the original authors of the
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