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Information card for entry 7118157
Preview
| Coordinates | 7118157.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H38 Ag F3 N2 O3 S |
|---|---|
| Calculated formula | C28 H38 Ag F3 N2 O3 S |
| SMILES | [Ag](=C1N(CCN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)OS(=O)(=O)C(F)(F)F |
| Title of publication | Structure and bonding of [(SIPr)AgX] (X = Cl, Br, I and OTf |
| Authors of publication | Valerie H. L. Wong; Andrew J. P. White; T. S. Andy Hor; King Kuok (Mimi) Hii |
| Journal of publication | Chem.Commun. |
| Year of publication | 2015 |
| Journal volume | 51 |
| Pages of publication | 17752 |
| a | 12.981 ± 0.0003 Å |
| b | 13.4443 ± 0.0003 Å |
| c | 17.5825 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3068.51 ± 0.12 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 7 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0306 |
| Residual factor for significantly intense reflections | 0.0269 |
| Weighted residual factors for significantly intense reflections | 0.0552 |
| Weighted residual factors for all reflections included in the refinement | 0.0571 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 171421 (current) | 2015-12-10 | cif/ Adding structures of 7118157, 7118158, 7118159, 7118160 via cif-deposit CGI script. |
7118157.cif |
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Users of the data should acknowledge the original authors of the
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