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Information card for entry 2228878
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| Coordinates | 2228878.cif |
|---|---|
| Structure factors | 2228878.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[diaqua-μ~3~-4-nitrophthalato-copper(II)] |
|---|---|
| Formula | C8 H7 Cu N O8 |
| Calculated formula | C8 H7 Cu N O8 |
| Title of publication | Poly[diaqua-μ~3~-4-nitrophthalato-copper(II)] |
| Authors of publication | Guo, Ming-Lin |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 1 |
| Pages of publication | m21 - m22 |
| a | 14.208 ± 0.003 Å |
| b | 6.5159 ± 0.0013 Å |
| c | 21.722 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2011 ± 0.7 Å3 |
| Cell temperature | 133 ± 2 K |
| Ambient diffraction temperature | 133 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.06 |
| Residual factor for significantly intense reflections | 0.0481 |
| Weighted residual factors for significantly intense reflections | 0.1378 |
| Weighted residual factors for all reflections included in the refinement | 0.1441 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181209 (current) | 2016-04-03 | hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/88. |
2228878.cif 2228878.hkl |
| 176789 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22. |
2228878.cif 2228878.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2228878.cif 2228878.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. | 2228878.cif 2228878.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2228878.cif 2228878.hkl |
| 11387 | 2011-02-15 | hkl/: Adding Reflection data for the recently deposited IUCr-originating structures. | 2228878.cif 2228878.hkl |
| 10124 | 2011-02-10 | ../uploads/cif-deposit/cod/cif Adding structures of 2228878 via cif-deposit CGI script. |
2228878.cif |
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Users of the data should acknowledge the original authors of the
structural data.