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Information card for entry 2231041
Preview
| Coordinates | 2231041.cif |
|---|---|
| Structure factors | 2231041.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[aquabis[μ~3~-4-(3-pyridyl)pyrimidine-2-sulfonato- κ^4^<i>N</i>^4^:<i>N</i>^1^,<i>O</i>:<i>O</i>][μ~2~-4-(3-pyridyl)pyrimidine- 2-sulfonato-κ^3^<i>N</i>^4^:<i>N</i>^1^,<i>O</i>]trisilver(I)] |
|---|---|
| Formula | C27 H22 Ag3 N9 O11 S3 |
| Calculated formula | C27 H22 Ag3 N9 O11 S3 |
| Title of publication | Poly[aquabis[μ~3~-4-(3-pyridyl)pyrimidine-2-sulfonato-κ^4^<i>N</i>^4^:<i>N</i>^1^,<i>O</i>:<i>O</i>][μ~2~-4-(3-pyridyl)pyrimidine-2-sulfonato-κ^3^<i>N</i>^4^:<i>N</i>^1^,<i>O</i>]trisilver(I)] |
| Authors of publication | Liu, Xia; Hu, Dahua |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 8 |
| Pages of publication | m1067 - m1068 |
| a | 19.0738 ± 0.0016 Å |
| b | 19.9598 ± 0.0017 Å |
| c | 8.6372 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3288.3 ± 0.5 Å3 |
| Cell temperature | 291 ± 2 K |
| Ambient diffraction temperature | 291 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0742 |
| Residual factor for significantly intense reflections | 0.0517 |
| Weighted residual factors for significantly intense reflections | 0.113 |
| Weighted residual factors for all reflections included in the refinement | 0.1186 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181232 (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 2/23/10. |
2231041.cif 2231041.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. |
2231041.cif 2231041.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2231041.cif 2231041.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. | 2231041.cif 2231041.hkl |
| 27511 | 2011-10-06 | hkl/ Committing assigned Fobs data for the recently deposited coordinates from IUCr journals. |
2231041.cif 2231041.hkl |
| 26933 | 2011-09-29 | ../uploads/cif-deposit/cod/cif Adding structures of 2231041 via cif-deposit CGI script. |
2231041.cif |
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Users of the data should acknowledge the original authors of the
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