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Information card for entry 2230145
Preview
| Coordinates | 2230145.cif |
|---|---|
| Structure factors | 2230145.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>cyclo</i>-Tetrakis(μ~2~-3-sulfidopropyl- κ^3^<i>C</i>^1^,<i>S</i>:<i>S</i>)tetrakis[chloridocobalt(III)] |
|---|---|
| Formula | C12 H24 Cl4 Co4 S4 |
| Calculated formula | C12 H24 Cl4 Co4 S4 |
| SMILES | C1CC[Co]2([S]1[Co]1([S]([Co]3(CCC[S]3[Co]3(CCC[S]23)Cl)Cl)CCC1)Cl)Cl |
| Title of publication | <i>cyclo</i>-Tetrakis(μ~2~-3-sulfidopropyl-κ^3^<i>C</i>^1^,<i>S</i>:<i>S</i>)tetrakis[chloridocobalt(III)] |
| Authors of publication | Awan, Shafique Ahmad; Tahir, M. Nawaz; Muhammad, Iram Khushi; Ahmad, Saeed; Tariq, Muhammad Ilyas |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 5 |
| Pages of publication | m576 - m577 |
| a | 23.6135 ± 0.0012 Å |
| b | 7.8465 ± 0.0003 Å |
| c | 16.8693 ± 0.0009 Å |
| α | 90° |
| β | 130.44 ± 0.004° |
| γ | 90° |
| Cell volume | 2378.8 ± 0.2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0518 |
| Residual factor for significantly intense reflections | 0.0413 |
| Weighted residual factors for significantly intense reflections | 0.1143 |
| Weighted residual factors for all reflections included in the refinement | 0.1245 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181223 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/01. |
2230145.cif 2230145.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2230145.cif 2230145.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2230145.cif 2230145.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. | 2230145.cif 2230145.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2230145.cif 2230145.hkl |
| 22560 | 2011-07-04 | hkl/ Adding Fobs files for the recent IUCr data deposition. |
2230145.cif 2230145.hkl |
| 20218 | 2011-06-03 | ../uploads/cif-deposit/cod/cif Adding structures of 2230145 via cif-deposit CGI script. |
2230145.cif |
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Users of the data should acknowledge the original authors of the
structural data.