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Information card for entry 2229263
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| Coordinates | 2229263.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[[[(3,5-dimethyl-1<i>H</i>-pyrazole)copper(II)]-μ- {<i>N</i>-[1-(2-oxidophenyl)ethylidene]-L-valinato}] methanol monosolvate] |
|---|---|
| Formula | C19 H27 Cu N3 O4 |
| Calculated formula | C19 H27 Cu N3 O4 |
| Title of publication | <i>catena</i>-Poly[[[(3,5-dimethyl-1<i>H</i>-pyrazole)copper(II)]-μ-{<i>N</i>-[1-(2-oxidophenyl)ethylidene]-<small>L</small>-valinato}] methanol monosolvate] |
| Authors of publication | Zhao, Gan-Qing; Li, Xu-Dong; Han, Yong-Jun; Xue, Ling-Wei; Peng, Qin-Long |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 2 |
| Pages of publication | m173 - m174 |
| a | 14.12 ± 0.02 Å |
| b | 15.44 ± 0.02 Å |
| c | 21.25 ± 0.03 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4633 ± 11 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.1229 |
| Residual factor for significantly intense reflections | 0.0544 |
| Weighted residual factors for significantly intense reflections | 0.1069 |
| Weighted residual factors for all reflections included in the refinement | 0.1297 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176789 (current) | 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. |
2229263.cif |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2229263.cif |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2229263.cif |
| 12356 | 2011-03-05 | ../uploads/cif-deposit/cod/cif Adding structures of 2229263 via cif-deposit CGI script. |
2229263.cif |
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