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Information card for entry 2235341
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| Coordinates | 2235341.cif |
|---|---|
| Structure factors | 2235341.hkl |
| Original IUCr paper | HTML |
| Chemical name | Aqua[1-(pyridin-2-yl)ethanone oximato][1-(pyridin-2-yl)ethanone oxime]copper(II) perchlorate monohydrate |
|---|---|
| Formula | C14 H19 Cl Cu N4 O8 |
| Calculated formula | C14 H19 Cl Cu N4 O8 |
| Title of publication | Aqua[1-(pyridin-2-yl)ethanone oximato][1-(2-pyridin-2-yl)ethanone oxime]copper(II) perchlorate monohydrate |
| Authors of publication | Zhong, Baoyun; Li, Shengli; Chen, Guifang |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 7 |
| Pages of publication | m874 |
| a | 6.3526 ± 0.0007 Å |
| b | 15.7199 ± 0.0014 Å |
| c | 9.8235 ± 0.0009 Å |
| α | 90° |
| β | 101.235 ± 0.001° |
| γ | 90° |
| Cell volume | 962.2 ± 0.16 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 7 |
| Hermann-Mauguin space group symbol | P 1 c 1 |
| Hall space group symbol | P -2yc |
| Residual factor for all reflections | 0.0423 |
| Residual factor for significantly intense reflections | 0.0367 |
| Weighted residual factors for significantly intense reflections | 0.0918 |
| Weighted residual factors for all reflections included in the refinement | 0.0956 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.999 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181275 (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 2/23/53. |
2235341.cif 2235341.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. |
2235341.cif 2235341.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2235341.cif 2235341.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. | 2235341.cif 2235341.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2235341.cif 2235341.hkl |
| 63779 | 2012-08-10 | cif/ Adding structures of 2235341 via cif-deposit CGI script. |
2235341.cif |
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Users of the data should acknowledge the original authors of the
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