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Information card for entry 2241362
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| Coordinates | 2241362.cif |
|---|---|
| Structure factors | 2241362.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | Bis(4-acetylanilinium) tetrachloridomercurate(II) |
|---|---|
| Formula | C16 H20 Cl4 Hg N2 O2 |
| Calculated formula | C16 H20 Cl4 Hg N2 O2 |
| SMILES | c1(ccc(cc1)[NH3+])C(=O)C.Cl[Hg](Cl)([Cl-])[Cl-].c1(ccc(cc1)[NH3+])C(=O)C |
| Title of publication | Crystal structure of bis(4-acetylanilinium) tetrachloridomercurate(II) |
| Authors of publication | Thairiyaraja, Manickam; Elangovan, Arumugam; Arivazhagan, Ganesh; Selvaraju, Kuthambalam; Thamotharan, Subbiah |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 12 |
| Pages of publication | m236 - m237 |
| a | 19.9231 ± 0.0006 Å |
| b | 15.3515 ± 0.0006 Å |
| c | 13.7587 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4208.1 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 64 |
| Hermann-Mauguin space group symbol | C m c e |
| Hall space group symbol | -C 2ac 2 |
| Residual factor for all reflections | 0.0419 |
| Residual factor for significantly intense reflections | 0.0233 |
| Weighted residual factors for significantly intense reflections | 0.0502 |
| Weighted residual factors for all reflections included in the refinement | 0.0562 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 206165 (current) | 2018-02-04 | cif/ Updating space group information in entries 2001632, 2002043, 2205693, 2210884, 2241207, 2241323, 2241362, 7036763, 7037291, 7037577, 7100674, 7118554, 7118555, 7118556, 7118557. |
2241362.cif 2241362.hkl |
| 181914 | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/13. |
2241362.cif 2241362.hkl |
| 170596 | 2015-11-29 | cif/ hkl/ Adding structures of 2241362 via cif-deposit CGI script. |
2241362.cif 2241362.hkl |
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Users of the data should acknowledge the original authors of the
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