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Information card for entry 2018788
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| Coordinates | 2018788.cif |
|---|---|
| Structure factors | 2018788.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[bis(4-chloropyridinium) tetra-μ~2~-chlorido-tetrachloridotrimercury(II)] |
|---|---|
| Formula | C10 H10 Cl10 Hg3 N2 |
| Calculated formula | C10 H10 Cl10 Hg3 N2 |
| SMILES | [Hg](Cl)Cl.[Hg](Cl)(Cl)[Cl][Hg](Cl)(Cl)Cl.Clc1cc[nH+]cc1.Clc1cc[nH+]cc1 |
| Title of publication | Poly[bis(4-chloropyridinium) tetra-μ~2~-chlorido-tetrachloridotrimercurate(II)] |
| Authors of publication | Jin, Lei; Wu, De-Hong |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 2 |
| Pages of publication | 142 - 145 |
| a | 4.1792 ± 0.0008 Å |
| b | 11.618 ± 0.002 Å |
| c | 13.238 ± 0.003 Å |
| α | 70.44 ± 0.03° |
| β | 83.71 ± 0.03° |
| γ | 89.91 ± 0.03° |
| Cell volume | 601.6 ± 0.2 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 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 | 0.0585 |
| Residual factor for significantly intense reflections | 0.0498 |
| Weighted residual factors for significantly intense reflections | 0.0994 |
| Weighted residual factors for all reflections included in the refinement | 0.104 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.92 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180856 (current) | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/87. |
2018788.cif 2018788.hkl |
| 176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2018788.cif 2018788.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2018788.cif 2018788.hkl |
| 75609 | 2013-03-10 | hkl/ (saulius@koala.ibt.lt) Adding newly assigned range 2 Fobs files. |
2018788.cif 2018788.hkl |
| 75364 | 2013-03-09 | cif/ Adding structures of 2018788 via cif-deposit CGI script. |
2018788.cif |
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Users of the data should acknowledge the original authors of the
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