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Information card for entry 2234341
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| Coordinates | 2234341.cif |
|---|---|
| Structure factors | 2234341.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[[(pyrazine-2-carboxylato)copper(II)]-μ- pyrazine-2-carboxylato] |
|---|---|
| Formula | C11.12 H7.12 Cu N2.88 O4 |
| Calculated formula | C11.12 H7.12 Cu N2.88 O4 |
| Title of publication | Disorder in the anionic part of <i>catena</i>-poly[[(pyrazine-2-carboxylato)copper(II)]-μ-pyrazine-2-carboxylato] |
| Authors of publication | Albanez, Joselyn; Brito, Iván; Cárdenas, Alejandro; López-Rodríguez, Matías |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 4 |
| Pages of publication | m498 - m499 |
| a | 5.1912 ± 0.001 Å |
| b | 7.3362 ± 0.0015 Å |
| c | 8.076 ± 0.0016 Å |
| α | 72.38 ± 0.03° |
| β | 73.35 ± 0.03° |
| γ | 72.06 ± 0.03° |
| Cell volume | 272.47 ± 0.11 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0223 |
| Residual factor for significantly intense reflections | 0.0216 |
| Weighted residual factors for significantly intense reflections | 0.0583 |
| Weighted residual factors for all reflections included in the refinement | 0.0588 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.101 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181265 (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 2/23/43. |
2234341.cif 2234341.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. |
2234341.cif 2234341.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2234341.cif 2234341.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. | 2234341.cif 2234341.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2234341.cif 2234341.hkl |
| 55612 | 2012-05-05 | cif/ Adding structures of 2234341 via cif-deposit CGI script. |
2234341.cif |
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Users of the data should acknowledge the original authors of the
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