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Information card for entry 1556580
Preview
| Coordinates | 1556580.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H36 F6 N O6 P Si2 |
|---|---|
| Calculated formula | C14 H36 F6 N O6 P Si2 |
| SMILES | C[Si]1(C)[Si](C)(C)OCCOCCOCCOCCOCCO1.[P](F)(F)(F)(F)(F)[F-].[NH4+] |
| Title of publication | Hybrid Disila-Crown Ethers as Hosts for Ammonium Cations: The O-Si-Si-O Linkage as an Acceptor for Hydrogen Bonding |
| Authors of publication | Dankert, F.; Reuter, K.; Donsbach, C.; Von Hanisch, C. |
| Journal of publication | Inorganics |
| Year of publication | 2018 |
| Journal volume | 6 |
| Pages of publication | 15 |
| a | 10.4542 ± 0.0005 Å |
| b | 12.3869 ± 0.0006 Å |
| c | 10.614 ± 0.0005 Å |
| α | 90° |
| β | 117.912 ± 0.001° |
| γ | 90° |
| Cell volume | 1214.57 ± 0.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 99.98 K |
| Number of distinct elements | 7 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0207 |
| Residual factor for significantly intense reflections | 0.0203 |
| Weighted residual factors for significantly intense reflections | 0.0528 |
| Weighted residual factors for all reflections included in the refinement | 0.0529 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 245200 (current) | 2019-12-16 | cif/ Adding structures of 1556580 via cif-deposit CGI script. |
1556580.cif |
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Users of the data should acknowledge the original authors of the
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