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Information card for entry 1514733
Preview
Coordinates | 1514733.cif |
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Original paper (by DOI) | HTML |
Formula | C38 H58 Mg N2 O2 Si |
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Calculated formula | C38 H58 Mg N2 O2 Si |
SMILES | [SiH2](N(c1c(C(C)C)cccc1C(C)C)[Mg]([O]1CCCC1)([O]1CCCC1)Nc1c(C(C)C)cccc1C(C)C)c1ccccc1 |
Title of publication | Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis |
Authors of publication | Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P. |
Journal of publication | Chemical Science |
Year of publication | 2013 |
Journal volume | 4 |
Journal issue | 11 |
Pages of publication | 4212 |
a | 11.294 ± 0.0004 Å |
b | 12.168 ± 0.0004 Å |
c | 13.604 ± 0.0004 Å |
α | 96.759 ± 0.002° |
β | 90.61 ± 0.002° |
γ | 90.961 ± 0.002° |
Cell volume | 1856.13 ± 0.11 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0989 |
Residual factor for significantly intense reflections | 0.0612 |
Weighted residual factors for significantly intense reflections | 0.1597 |
Weighted residual factors for all reflections included in the refinement | 0.1843 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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