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Information card for entry 2239089
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| Coordinates | 2239089.cif |
|---|---|
| Structure factors | 2239089.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | Dichlorido{8-[2-(dimethylamino)ethylamino]quinoline-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''}zinc |
|---|---|
| Formula | C13 H17 Cl2 N3 Zn |
| Calculated formula | C13 H17 Cl2 N3 Zn |
| SMILES | c1ccc2c3c(ccc2)[NH]2CC[N](C)(C)[Zn]2(Cl)(Cl)[n]13 |
| Title of publication | Dichlorido{8-[2-(dimethylamino)ethylamino]quinoline-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''}zinc |
| Authors of publication | Al-Sudani, Abdul-Razak H. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 1 |
| Pages of publication | m1 |
| a | 23.6403 ± 0.0006 Å |
| b | 7.5682 ± 0.0002 Å |
| c | 8.0329 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1437.2 ± 0.08 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.0357 |
| Residual factor for significantly intense reflections | 0.0301 |
| Weighted residual factors for significantly intense reflections | 0.0635 |
| Weighted residual factors for all reflections included in the refinement | 0.0661 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.071 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181890 (current) | 2016-04-06 | hkl/2/23/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/23/90. |
2239089.cif 2239089.hkl |
| 181309 | 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 2/23/90. |
2239089.cif 2239089.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. |
2239089.cif 2239089.hkl |
| 104978 | 2014-03-11 | cif/ hkl/ Adding structures of 2239089 via cif-deposit CGI script. |
2239089.cif 2239089.hkl |
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