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Information card for entry 7707663
Preview
| Coordinates | 7707663.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H80 Mg N2 O2 |
|---|---|
| Calculated formula | C58 H80 Mg N2 O2 |
| Title of publication | C-H and C-F coordination of arenes in neutral alkaline earth metal complexes. |
| Authors of publication | McMullen, Jacob S.; Edwards, Alison J.; Hicks, Jamie |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2021 |
| Journal volume | 50 |
| Journal issue | 25 |
| Pages of publication | 8685 - 8689 |
| a | 11.477 ± 0.0003 Å |
| b | 11.6476 ± 0.0003 Å |
| c | 22.193 ± 0.0006 Å |
| α | 102.158 ± 0.002° |
| β | 93.494 ± 0.002° |
| γ | 112.779 ± 0.003° |
| Cell volume | 2640.38 ± 0.14 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150.15 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0464 |
| Residual factor for significantly intense reflections | 0.0414 |
| Weighted residual factors for significantly intense reflections | 0.1078 |
| Weighted residual factors for all reflections included in the refinement | 0.1126 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 267175 (current) | 2021-07-05 | cif/ Updating files of 7707658, 7707659, 7707660, 7707661, 7707662, 7707663, 7707664 Original log message: Adding full bibliography for 7707658--7707664.cif. |
7707663.cif |
| 266454 | 2021-06-15 | cif/ Adding structures of 7707658, 7707659, 7707660, 7707661, 7707662, 7707663, 7707664 via cif-deposit CGI script. |
7707663.cif |
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Users of the data should acknowledge the original authors of the
structural data.