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Information card for entry 2235327
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| Coordinates | 2235327.cif |
|---|---|
| Structure factors | 2235327.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[bis(μ~7~-3-sulfonato-<i>L</i>-alaninato)sodiumzinc] |
|---|---|
| Formula | C6 H10 N2 Na2 O10 S2 Zn |
| Calculated formula | C6 H10 N2 Na2 O10 S2 Zn |
| Title of publication | Poly[bis(μ~7~-3-sulfonato-<small>L</small>-alaninato)sodiumzinc] |
| Authors of publication | Li, Xiao-lin; Yu, Jing; Liu, Li |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 6 |
| Pages of publication | m849 |
| a | 13.2432 ± 0.0006 Å |
| b | 6.1574 ± 0.0002 Å |
| c | 8.5959 ± 0.0003 Å |
| α | 90° |
| β | 98.155 ± 0.002° |
| γ | 90° |
| Cell volume | 693.85 ± 0.05 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0273 |
| Residual factor for significantly intense reflections | 0.027 |
| Weighted residual factors for significantly intense reflections | 0.0752 |
| Weighted residual factors for all reflections included in the refinement | 0.0754 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.97 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| 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. |
2235327.cif 2235327.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. |
2235327.cif 2235327.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2235327.cif 2235327.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. | 2235327.cif 2235327.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2235327.cif 2235327.hkl |
| 62014 | 2012-07-05 | cif/ Adding structures of 2235327 via cif-deposit CGI script. |
2235327.cif |
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Users of the data should acknowledge the original authors of the
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