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Information card for entry 2240772
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| Coordinates | 2240772.cif |
|---|---|
| Structure factors | 2240772.hkl |
| Original IUCr paper | HTML |
| Chemical name | Aqua{μ-<i>N</i>-[3-(dimethylamino)propyl]-<i>N</i>'-2-(oxidophenyl)oxamidato}(1,10-phenanthroline-5,6-dione)dicopper(II) perchlorate hemihydrate |
|---|---|
| Formula | C25 H25 Cl Cu2 N5 O10.5 |
| Calculated formula | C25 H25 Cl Cu2 N5 O10.5 |
| Title of publication | Crystal structure of aqua{μ-<i>N</i>-[3-(dimethylamino)propyl]-<i>N</i>'-2-(oxidophenyl)oxamidato}(1,10-phenanthroline-5,6-dione)dicopper(II) perchlorate hemihydrate |
| Authors of publication | Zhang, Xin; Li, Yan-Tuan; Wu, Zhi-Yong |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 6 |
| Pages of publication | 667 - 670 |
| a | 11.743 ± 0.0006 Å |
| b | 17.3066 ± 0.0009 Å |
| c | 14.1086 ± 0.0008 Å |
| α | 90° |
| β | 98.154 ± 0.001° |
| γ | 90° |
| Cell volume | 2838.3 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0793 |
| Residual factor for significantly intense reflections | 0.0503 |
| Weighted residual factors for significantly intense reflections | 0.1021 |
| Weighted residual factors for all reflections included in the refinement | 0.1142 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181907 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/07 |
2240772.cif 2240772.hkl |
| 176429 | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
2240772.cif 2240772.hkl |
| 137306 | 2015-05-24 | cif/ hkl/ Adding structures of 2240772 via cif-deposit CGI script. |
2240772.cif 2240772.hkl |
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Users of the data should acknowledge the original authors of the
structural data.