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Information card for entry 2232819
Preview
| Coordinates | 2232819.cif |
|---|---|
| Structure factors | 2232819.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[(μ~3~-5-aminoisophthalato- κ^3^<i>O</i>^1^:<i>O</i>^3^:<i>N</i>)(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc] 0.25-hydrate] |
|---|---|
| Formula | C11 H9.5 N3 O4.25 Zn |
| Calculated formula | C11 H9.5 N3 O4.25 Zn |
| Title of publication | Poly[[(μ~3~-5-aminoisophthalato-κ^3^<i>O</i>^1^:<i>O</i>^3^:<i>N</i>)(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc] 0.25-hydrate] |
| Authors of publication | Kuai, Hai-Wei; Cheng, Xiao-Chun |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 12 |
| Pages of publication | m1835 |
| a | 9.6239 ± 0.0011 Å |
| b | 10.1916 ± 0.0011 Å |
| c | 12.1927 ± 0.0013 Å |
| α | 90° |
| β | 95.146 ± 0.002° |
| γ | 90° |
| Cell volume | 1191.1 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 291 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0655 |
| Residual factor for significantly intense reflections | 0.0479 |
| Weighted residual factors for significantly intense reflections | 0.0957 |
| Weighted residual factors for all reflections included in the refinement | 0.0983 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181250 (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 2/23/28. |
2232819.cif 2232819.hkl |
| 176435 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
2232819.cif 2232819.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2232819.cif 2232819.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. | 2232819.cif 2232819.hkl |
| 31968 | 2012-01-03 | hkl/ Adding automatically assigned IUCr Fobs data for the rest of the year 2001 structures. |
2232819.cif 2232819.hkl |
| 31698 | 2012-01-02 | ../uploads/cif-deposit/cod/cif Adding structures of 2232819 via cif-deposit CGI script. |
2232819.cif |
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Users of the data should acknowledge the original authors of the
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