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Information card for entry 2228783
Preview
| Coordinates | 2228783.cif |
|---|---|
| Structure factors | 2228783.hkl |
| Original IUCr paper | HTML |
| Chemical name | Di-μ-chlorido-bis{[2-(benzyliminomethyl)pyridine- κ^2^<i>N</i>,<i>N</i>']chloridomercury(II)} dichloridomercury(II) |
|---|---|
| Formula | C26 H24 Cl6 Hg3 N4 |
| Calculated formula | C26 H24 Cl6 Hg3 N4 |
| SMILES | c1cccc2C=[N](Cc3ccccc3)[Hg]3([n]12)(Cl)[Cl][Hg]1([n]2ccccc2C=[N]1Cc1ccccc1)(Cl)[Cl]3.[Hg](Cl)Cl |
| Title of publication | Di-μ-chlorido-bis{[2-(benzyliminomethyl)pyridine-κ^2^<i>N</i>,<i>N</i>']chloridomercury(II)} dichloridomercury(II) |
| Authors of publication | Kim, Young-Inn; Song, Young-Kwang; Yun, Seong-Jae; Kim, In-Chan; Kang, Sung Kwon |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 1 |
| Pages of publication | m52 - m53 |
| a | 10.1329 ± 0.0002 Å |
| b | 8.1141 ± 0.0001 Å |
| c | 19.0591 ± 0.0002 Å |
| α | 90° |
| β | 92.939 ± 0.001° |
| γ | 90° |
| Cell volume | 1564.97 ± 0.04 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for significantly intense reflections | 0.0246 |
| Weighted residual factors for all reflections included in the refinement | 0.0554 |
| 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 |
|---|---|---|---|
| 181208 (current) | 2016-04-03 | hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/87. |
2228783.cif 2228783.hkl |
| 176789 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22. |
2228783.cif 2228783.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2228783.cif 2228783.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. | 2228783.cif 2228783.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2228783.cif 2228783.hkl |
| 11387 | 2011-02-15 | hkl/: Adding Reflection data for the recently deposited IUCr-originating structures. | 2228783.cif 2228783.hkl |
| 9934 | 2011-02-10 | ../uploads/cif-deposit/cod/cif Adding structures of 2228783 via cif-deposit CGI script. |
2228783.cif |
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Users of the data should acknowledge the original authors of the
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