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Information card for entry 1542877
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| Coordinates | 1542877.cif |
|---|---|
| Structure factors | 1542877.hkl |
| Original IUCr paper | HTML |
| Chemical name | Tetramethylammonium trifluoromethanesulfonate |
|---|---|
| Formula | C5 H12 F3 N O3 S |
| Calculated formula | C5 H12 F3 N O3 S |
| Title of publication | Tetramethylammonium trifluoromethanesulfonate |
| Authors of publication | Bourque, Jeremy L.; Baines, Kim M. |
| Journal of publication | IUCrData |
| Year of publication | 2016 |
| Journal volume | 1 |
| Journal issue | 3 |
| Pages of publication | x160370 |
| a | 10.216 ± 0.003 Å |
| b | 8.507 ± 0.002 Å |
| c | 11.445 ± 0.004 Å |
| α | 90° |
| β | 101.807 ± 0.017° |
| γ | 90° |
| Cell volume | 973.6 ± 0.5 Å3 |
| Cell temperature | 110 K |
| Ambient diffraction temperature | 110 K |
| Number of distinct elements | 6 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Residual factor for all reflections | 0.0581 |
| Residual factor for significantly intense reflections | 0.0395 |
| Weighted residual factors for significantly intense reflections | 0.0988 |
| Weighted residual factors for all reflections included in the refinement | 0.1057 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181861 (current) | 2016-04-06 | hkl/ (antanas@echidna.ibt.lt) Adding IUCr specific svn headers to multiple entries in range 1. |
1542877.cif 1542877.hkl |
| 178204 | 2016-03-15 | cif/ hkl/ Adding structures of 1542877 via cif-deposit CGI script. |
1542877.cif 1542877.hkl |
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Users of the data should acknowledge the original authors of the
structural data.