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Information card for entry 7003168
Preview
| Coordinates | 7003168.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Tetrafluorido(2,7-dimethyl-3,6-dithiaoctane)tin(IV) |
|---|---|
| Chemical name | Tetrafluorido(2,7-dimethyl-3,6-dithiaoctane)tin(IV) |
| Formula | C8 H18 F4 S2 Sn |
| Calculated formula | C8 H18 F4 S2 Sn |
| SMILES | CC(C)[S]1[Sn](F)(F)(F)(F)[S](C(C)C)CC1 |
| Title of publication | The first examples of germanium tetrafluoride and tin tetrafluoride complexes with soft thioether coordination—synthesis, properties and crystal structures |
| Authors of publication | Davis, Martin F.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian |
| Journal of publication | Dalton Transactions |
| Year of publication | 2008 |
| Journal issue | 4 |
| Pages of publication | 533 - 538 |
| a | 10.54 ± 0.003 Å |
| b | 7.573 ± 0.002 Å |
| c | 17.642 ± 0.005 Å |
| α | 90° |
| β | 97.456 ± 0.01° |
| γ | 90° |
| Cell volume | 1396.3 ± 0.7 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0215 |
| Residual factor for significantly intense reflections | 0.019 |
| Weighted residual factors for significantly intense reflections | 0.0381 |
| Weighted residual factors for all reflections included in the refinement | 0.0391 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.121 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179735 (current) | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/31. |
7003168.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7003168.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7003168.cif |
| 1173 | 2010-05-16 | cif/7/: adding data from Dalton-Trans-2008, New-J-Chem-2008, Org-Biomol-Chem-2008 and RSC-2008 processing. | 7003168.cif |
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Users of the data should acknowledge the original authors of the
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