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Information card for entry 2231188
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| Coordinates | 2231188.cif |
|---|---|
| Structure factors | 2231188.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[[(3-methylpyridine)copper(I)]-μ-cyanido-copper(I)-\ μ-cyanido] |
|---|---|
| Formula | C8 H7 Cu2 N3 |
| Calculated formula | C8 H7 Cu2 N3 |
| Title of publication | <i>catena</i>-Poly[[(3-methylpyridine)copper(I)]-μ-cyanido-copper(I)-μ-cyanido] |
| Authors of publication | Cai, Jin-Biao; Chen, Ting-Ting; Xie, Ze-Ying; Deng, Hong |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 8 |
| Pages of publication | m1136 - m1137 |
| a | 9.3027 ± 0.0018 Å |
| b | 12.09 ± 0.002 Å |
| c | 8.8738 ± 0.0017 Å |
| α | 90° |
| β | 105.927 ± 0.002° |
| γ | 90° |
| Cell volume | 959.7 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0526 |
| Residual factor for significantly intense reflections | 0.0418 |
| Weighted residual factors for significantly intense reflections | 0.1099 |
| Weighted residual factors for all reflections included in the refinement | 0.118 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181233 (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 2/23/11. |
2231188.cif 2231188.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. |
2231188.cif 2231188.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2231188.cif 2231188.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. | 2231188.cif 2231188.hkl |
| 27511 | 2011-10-06 | hkl/ Committing assigned Fobs data for the recently deposited coordinates from IUCr journals. |
2231188.cif 2231188.hkl |
| 27098 | 2011-09-29 | ../uploads/cif-deposit/cod/cif Adding structures of 2231188 via cif-deposit CGI script. |
2231188.cif |
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Users of the data should acknowledge the original authors of the
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