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Information card for entry 1552003
Preview
| Coordinates | 1552003.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C63 H92 B2 Ge2 N6 |
|---|---|
| Calculated formula | C63 H92 B2 Ge2 N6 |
| SMILES | [Ge]([Ge](B1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)=C1N(C(=C(C)N1C(C)C)C)C(C)C)B1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C |
| Title of publication | A stable heavier group 14 analogue of vinylidene |
| Authors of publication | Arnab Rit; Jesus Campos; Haoyu Niu; Simon Aldridge |
| Journal of publication | Nature Chemistry |
| Year of publication | 2016 |
| Journal volume | 8 |
| Pages of publication | 1022 - 1026 |
| a | 51.304 ± 0.002 Å |
| b | 13.7692 ± 0.0006 Å |
| c | 27.1756 ± 0.0005 Å |
| α | 90° |
| β | 101.731 ± 0.003° |
| γ | 90° |
| Cell volume | 18796.3 ± 1.2 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.1066 |
| Residual factor for significantly intense reflections | 0.0793 |
| Weighted residual factors for significantly intense reflections | 0.2115 |
| Weighted residual factors for all reflections included in the refinement | 0.2418 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.12 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216812 (current) | 2019-07-08 | cif/ Adding structures of 1552003 via cif-deposit CGI script. |
1552003.cif |
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Users of the data should acknowledge the original authors of the
structural data.