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Information card for entry 1556510
Preview
| Coordinates | 1556510.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C48 H52 I Mg N3 O |
|---|---|
| Calculated formula | C48 H52 I Mg N3 O |
| SMILES | [Mg]1(I)([N](=NN1c1c(cccc1c1cc(cc(c1)C)C)c1cc(cc(c1)C)C)c1c(cccc1c1cc(cc(c1)C)C)c1cc(cc(c1)C)C)[O](CC)CC |
| Title of publication | Hetero- and Homoleptic Magnesium Triazenides |
| Authors of publication | Vindus, D.; Niemeyer, M. |
| Journal of publication | Inorganics |
| Year of publication | 2017 |
| Journal volume | 5 |
| Pages of publication | 33 |
| a | 19.848 ± 0.004 Å |
| b | 9.373 ± 0.002 Å |
| c | 23.033 ± 0.004 Å |
| α | 90° |
| β | 90.386 ± 0.014° |
| γ | 90° |
| Cell volume | 4284.9 ± 1.5 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0545 |
| Residual factor for significantly intense reflections | 0.0359 |
| Weighted residual factors for significantly intense reflections | 0.0858 |
| Weighted residual factors for all reflections included in the refinement | 0.0897 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.886 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244995 (current) | 2019-12-11 | cif/ Adding structures of 1556509, 1556510, 1556511, 1556512, 1556513, 1556514 via cif-deposit CGI script. |
1556510.cif |
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Users of the data should acknowledge the original authors of the
structural data.