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Information card for entry 7212932
Preview
| Coordinates | 7212932.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H4 Br2 Cu N2 S4 |
|---|---|
| Calculated formula | C8 H4 Br2 Cu N2 S4 |
| Title of publication | Metallic coordination supramolecule, [Cu(i)Cl0.2Br1.3(pyra-TTF)0.5+] |
| Authors of publication | Ichikawa, Shun; Takahashi, Kazuyuki; Matsuda, Masaki; Tajima, Hiroyuki; Mori, Hatsumi |
| Journal of publication | Journal of Materials Chemistry |
| Year of publication | 2010 |
| Journal volume | 20 |
| Journal issue | 45 |
| Pages of publication | 10130 |
| a | 8.776 ± 0.017 Å |
| b | 13.2 ± 0.02 Å |
| c | 10.786 ± 0.019 Å |
| α | 90° |
| β | 93.665 ± 0.018° |
| γ | 90° |
| Cell volume | 1247 ± 4 Å3 |
| Cell temperature | 293.3 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 0.0607 |
| Weighted residual factors for all reflections included in the refinement | 0.1692 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7212932.cif |
| 93678 | 2014-01-13 | cif/ Adding structures of 7212929, 7212930, 7212931, 7212932 via cif-deposit CGI script. |
7212932.cif |
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Users of the data should acknowledge the original authors of the
structural data.