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Information card for entry 2018914
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| Coordinates | 2018914.cif |
|---|---|
| Structure factors | 2018914.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-poly[[copper(II)-bis[μ-3-carboxy-5-[(imidazol-1-yl)methyl]benzoato]] dimethylacetamide disolvate] |
|---|---|
| Formula | C32 H36 Cu N6 O10 |
| Calculated formula | C32 H36 Cu N6 O10 |
| Title of publication | A one-dimensional coordination polymer of 5-[(imidazol-1-yl)methyl]benzene-1,3-dicarboxylic acid with Cu^II^ cations |
| Authors of publication | Patra, Ranjan; Goldberg, Israel |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 4 |
| Pages of publication | 344 - 347 |
| a | 7.7557 ± 0.0002 Å |
| b | 21.9826 ± 0.0004 Å |
| c | 9.816 ± 0.0003 Å |
| α | 90° |
| β | 102.92 ± 0.0009° |
| γ | 90° |
| Cell volume | 1631.17 ± 0.07 Å3 |
| Cell temperature | 110 ± 2 K |
| Ambient diffraction temperature | 110 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0786 |
| Residual factor for significantly intense reflections | 0.0485 |
| Weighted residual factors for significantly intense reflections | 0.1161 |
| Weighted residual factors for all reflections included in the refinement | 0.1294 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180858 (current) | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/89. |
2018914.cif 2018914.hkl |
| 176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2018914.cif 2018914.hkl |
| 88055 | 2013-08-28 | cod/cif/ (saulius@koala.ibt.lt) Adding the _cod_database_fobs_code links for those COD CIFs that have their Fobs deposited recently. |
2018914.cif 2018914.hkl |
| 88054 | 2013-08-28 | cod/hkl/ (saulius@koala.ibt.lt) Adding Fobs files for the recently deposited IUCr coordinate data. |
2018914.cif 2018914.hkl |
| 85399 | 2013-05-07 | cif/ Adding structures of 2018913, 2018914 via cif-deposit CGI script. |
2018914.cif |
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Users of the data should acknowledge the original authors of the
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