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Information card for entry 7055235
Preview
Coordinates | 7055235.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H42 Na O8 |
---|---|
Calculated formula | C26 H42 Na O8 |
SMILES | C1C[O]2CC[O]3CC[O]4CC[O]5CC[O]6CC[O]1[Na]123456[O](CC[O]1C)C.c12ccccc2cccc1 |
Title of publication | Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6 |
Authors of publication | Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye |
Journal of publication | New J. Chem. |
Year of publication | 2016 |
Journal volume | 40 |
Journal issue | 3 |
Pages of publication | 1923 |
a | 8.6161 ± 0.0008 Å |
b | 15.756 ± 0.0014 Å |
c | 19.686 ± 0.0018 Å |
α | 90° |
β | 98.022 ± 0.002° |
γ | 90° |
Cell volume | 2646.3 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1053 |
Residual factor for significantly intense reflections | 0.0487 |
Weighted residual factors for significantly intense reflections | 0.0853 |
Weighted residual factors for all reflections included in the refinement | 0.1037 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7055235.html
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Users of the data should acknowledge the original authors of the
structural data.