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Information card for entry 1550551
Preview
Coordinates | 1550551.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C76 H80 Mg2 N2 Si2 |
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Calculated formula | C76 H80 Mg2 N2 Si2 |
SMILES | [Mg](N([Si](C)(C)C)c1c(cc(cc1C(c1ccccc1)c1ccccc1)C(C)C)C(c1ccccc1)c1ccccc1)[Mg]N([Si](C)(C)C)c1c(cc(cc1C(c1ccccc1)c1ccccc1)C(C)C)C(c1ccccc1)c1ccccc1 |
Title of publication | Acyclic 1,2-Dimagnesioethanes/-ethene Derived from Magnesium(I) Compounds: Multipurpose Reagents for Organometallic Synthesis |
Authors of publication | Jones, Cameron; Dange, Deepak; Gair, Andrew; Jones, Dafydd; Juckel, Martin; Aldridge, Simon |
Journal of publication | Chemical Science |
Year of publication | 2019 |
a | 11.1004 ± 0.0001 Å |
b | 16.2687 ± 0.0003 Å |
c | 18.3324 ± 0.0002 Å |
α | 90° |
β | 103.171 ± 0.001° |
γ | 90° |
Cell volume | 3223.54 ± 0.08 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0584 |
Residual factor for significantly intense reflections | 0.0451 |
Weighted residual factors for significantly intense reflections | 0.1129 |
Weighted residual factors for all reflections included in the refinement | 0.1199 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1550551.html
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