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Information card for entry 7029719
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| Coordinates | 7029719.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [Bis(quinolinium)mercury(II)][thiocyanate] |
|---|---|
| Formula | C20 H14 Hg N4 S2 |
| Calculated formula | C20 H14 Hg N4 S2 |
| SMILES | N#C[S-].[Hg](c1cccc2ccc[nH+]c12)c1cccc2ccc[nH+]c12.N#C[S-] |
| Title of publication | Preparation of RHgCl via transmetalation of (8-quinolyl)SnMe3 and redistribution to R2Hg (R = 8-quinolyl): a highly distorted diorganomercury(ii) with 84 degree C-Hg-C angle. |
| Authors of publication | Tamang, Sem Raj; Son, Jung-Ho; Hoefelmeyer, James D |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2014 |
| Journal volume | 43 |
| Journal issue | 19 |
| Pages of publication | 7139 - 7145 |
| a | 6.86 ± 0.003 Å |
| b | 8.202 ± 0.004 Å |
| c | 9.116 ± 0.004 Å |
| α | 107.127 ± 0.005° |
| β | 110.701 ± 0.005° |
| γ | 94.266 ± 0.005° |
| Cell volume | 449.3 ± 0.4 Å3 |
| Cell temperature | 100 ± 0 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0495 |
| Residual factor for significantly intense reflections | 0.0495 |
| Weighted residual factors for significantly intense reflections | 0.1298 |
| Weighted residual factors for all reflections included in the refinement | 0.1298 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.094 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180003 (current) | 2016-03-25 | cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/97. |
7029719.cif |
| 111183 | 2014-04-21 | cif/ Updating files of 7029719 Original log message: Adding full bibliography for ./tmp-cod-update-bibliographies-12899/cifs/7029719.cif. |
7029719.cif |
| 109537 | 2014-04-16 | cif/ Adding structures of 7029717, 7029718, 7029719, 7029720 via cif-deposit CGI script. |
7029719.cif |
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Users of the data should acknowledge the original authors of the
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