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Information card for entry 4342137
Preview
| Coordinates | 4342137.cif | 
|---|---|
| Original paper (by DOI) | HTML | 
| Common name | Hg (O Te F5)5,(N CH3)4,(N CH3)4,(N CH3)4 | 
|---|---|
| Formula | C12 H36 F25 Hg N3 O5 Te5 | 
| Calculated formula | C12 H36 F25 Hg N3 O5 Te5 | 
| SMILES | [Hg](O[Te](F)(F)(F)(F)F)(O[Te](F)(F)(F)(F)F)(O[Te](F)(F)(F)(F)F)(O[Te](F)(F)(F)(F)F)O[Te](F)(F)(F)(F)F.[N+](C)(C)(C)C.[N+](C)(C)(C)C.[N+](C)(C)(C)C | 
| Title of publication | Pentafluoro-oxotellurate(VI) Anions of Mercury(II); Syntheses and Structures of [Hg(OTeF5)4](2-), [Hg(OTeF5)5](3-), [Hg2(OTeF5)6](2-), [Hg(OTeF5)4](2-)·Hg(OTeF5)2, and [Hg2(OTeF5)7](3-)·Hg(OTeF5)2. | 
| Authors of publication | DeBackere, John R.; Mercier, Hélène P A; Schrobilgen, Gary J. | 
| Journal of publication | Inorganic chemistry | 
| Year of publication | 2015 | 
| Journal volume | 54 | 
| Journal issue | 4 | 
| Pages of publication | 1606 - 1626 | 
| a | 16.2076 ± 0.0019 Å | 
| b | 14.4552 ± 0.0011 Å | 
| c | 16.2482 ± 0.0012 Å | 
| α | 90° | 
| β | 90.172 ± 0.003° | 
| γ | 90° | 
| Cell volume | 3806.7 ± 0.6 Å3 | 
| Cell temperature | 100 ± 2 K | 
| Ambient diffraction temperature | 100 ± 2 K | 
| Number of distinct elements | 7 | 
| Space group number | 9 | 
| Hermann-Mauguin space group symbol | C 1 c 1 | 
| Hall space group symbol | C -2yc | 
| Residual factor for all reflections | 0.0204 | 
| Residual factor for significantly intense reflections | 0.0196 | 
| Weighted residual factors for significantly intense reflections | 0.0421 | 
| Weighted residual factors for all reflections included in the refinement | 0.0424 | 
| Goodness-of-fit parameter for all reflections included in the refinement | 0.99 | 
| Diffraction radiation wavelength | 0.71073 Å | 
| Diffraction radiation type | MoKα | 
| Has coordinates | Yes | 
| Has disorder | No | 
| Has Fobs | No | 
| Revision | Date | Message | Files | 
|---|---|---|---|
| 179524 (current) | 2016-03-24 | cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/21. | 4342137.cif | 
| 132779 | 2015-03-04 | cif/ Updating files of 4342136, 4342137, 4342138, 4342139, 4342140, 4342141 Original log message: Adding full bibliography for 4342136--4342141.cif. | 4342137.cif | 
| 130386 | 2015-02-04 | cif/ Adding structures of 4342136, 4342137, 4342138, 4342139, 4342140, 4342141 via cif-deposit CGI script. | 4342137.cif | 
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          Users of the data should acknowledge the original authors of the
          structural data.