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Information card for entry 2230205
Preview
| Coordinates | 2230205.cif |
|---|---|
| Structure factors | 2230205.hkl |
| Original IUCr paper | HTML |
| Chemical name | [2-Amino-4,6-bis(2-pyridyl)-1,3,5-triazine- κ^3^<i>N</i>^4^,<i>N</i>^5^,<i>N</i>^6^]dichloridocadmium(II) |
|---|---|
| Formula | C13 H10 Cd Cl2 N6 |
| Calculated formula | C13 H10 Cd Cl2 N6 |
| SMILES | [Cd]12(Cl)(Cl)[n]3ccccc3c3[n]1c(nc(n3)N)c1[n]2cccc1 |
| Title of publication | [2-Amino-4,6-bis(2-pyridyl)-1,3,5-triazine-κ^3^<i>N</i>^4^,<i>N</i>^5^,<i>N</i>^6^]dichloridocadmium(II) |
| Authors of publication | Cao, Man-Li; Shi, Lei |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 5 |
| Pages of publication | m638 |
| a | 8.875 ± 0.0006 Å |
| b | 9.201 ± 0.0007 Å |
| c | 10.2677 ± 0.0007 Å |
| α | 82.5151 ± 0.0009° |
| β | 65.636 ± 0.001° |
| γ | 82.798 ± 0.001° |
| Cell volume | 754.89 ± 0.09 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0205 |
| Residual factor for significantly intense reflections | 0.0196 |
| Weighted residual factors for significantly intense reflections | 0.0547 |
| Weighted residual factors for all reflections included in the refinement | 0.0559 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181224 (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 2/23/02. |
2230205.cif 2230205.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. |
2230205.cif 2230205.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2230205.cif 2230205.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. | 2230205.cif 2230205.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2230205.cif 2230205.hkl |
| 22560 | 2011-07-04 | hkl/ Adding Fobs files for the recent IUCr data deposition. |
2230205.cif 2230205.hkl |
| 20286 | 2011-06-03 | ../uploads/cif-deposit/cod/cif Adding structures of 2230205 via cif-deposit CGI script. |
2230205.cif |
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Users of the data should acknowledge the original authors of the
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