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Information card for entry 7222038
Preview
| Coordinates | 7222038.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | hexaphenyldisiloxane |
|---|---|
| Chemical name | di(triphenylsilane)ether |
| Formula | C36 H30 O Si2 |
| Calculated formula | C36 H30 O Si2 |
| SMILES | c1(ccccc1)[Si](c1ccccc1)(O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1 |
| Title of publication | Synthesis, characterization and theoretical calculations of model compounds of silanols catalyzed by TEMPO to elucidate the presence of Si-O-Si and Si-O-N bonds. |
| Authors of publication | Percino, M. Judith; Pacheco, José Alberto; Soriano, Guillermo; Ceron, Margarita; Castro, María Eugenia; Chapela, Víctor M.; bonilla-cruz, jose; Lara, Tania; Flores, Mildred; Saldivar, Enrique |
| Journal of publication | RSC Adv. |
| Year of publication | 2015 |
| a | 8.5829 ± 0.0004 Å |
| b | 9.4856 ± 0.0004 Å |
| c | 10.9694 ± 0.0005 Å |
| α | 95.951 ± 0.004° |
| β | 111.779 ± 0.004° |
| γ | 113.352 ± 0.004° |
| Cell volume | 727.71 ± 0.07 Å3 |
| Cell temperature | 110 ± 2 K |
| Ambient diffraction temperature | 110 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0328 |
| Residual factor for significantly intense reflections | 0.0318 |
| Weighted residual factors for significantly intense reflections | 0.0821 |
| Weighted residual factors for all reflections included in the refinement | 0.0828 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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The link is: https://www.crystallography.net/7222038.html
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Users of the data should acknowledge the original authors of the
structural data.