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Information card for entry 7705033
Preview
| Coordinates | 7705033.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C87 H87 Mg N3 Si2 |
|---|---|
| Calculated formula | C87 H87 Mg N3 Si2 |
| SMILES | [Si](N([Si](C)(C)C)[Mg]1[N](=C(N1c1c(C(c2ccccc2)c2ccccc2)cc(cc1C(c1ccccc1)c1ccccc1)C)c1ccc(cc1)C)c1c(C(c2ccccc2)c2ccccc2)cc(cc1C(c1ccccc1)c1ccccc1)C)(C)(C)C.Cc1ccccc1 |
| Title of publication | Magnesium hydrides bearing sterically demanding amidinate ligands: synthesis, reactivity and catalytic application. |
| Authors of publication | Bakewell, Clare |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2020 |
| Journal volume | 49 |
| Journal issue | 32 |
| Pages of publication | 11354 - 11360 |
| a | 15.613 ± 0.0003 Å |
| b | 17.0913 ± 0.0003 Å |
| c | 17.1689 ± 0.0003 Å |
| α | 84.511 ± 0.002° |
| β | 69.542 ± 0.002° |
| γ | 64.578 ± 0.002° |
| Cell volume | 3868.84 ± 0.15 Å3 |
| Cell temperature | 150.41 ± 0.14 K |
| Ambient diffraction temperature | 150.41 ± 0.14 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 | 0.0486 |
| Residual factor for significantly intense reflections | 0.0413 |
| Weighted residual factors for significantly intense reflections | 0.1067 |
| Weighted residual factors for all reflections included in the refinement | 0.1124 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7705033.cif |
| 256067 | 2020-09-06 | cif/ Updating files of 7705030, 7705031, 7705032, 7705033, 7705034 Original log message: Adding full bibliography for 7705030--7705034.cif. |
7705033.cif |
| 254829 | 2020-08-05 | cif/ Adding structures of 7705030, 7705031, 7705032, 7705033, 7705034 via cif-deposit CGI script. |
7705033.cif |
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Users of the data should acknowledge the original authors of the
structural data.