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Information card for entry 1557181
Preview
| Coordinates | 1557181.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H30 N4 S2 |
|---|---|
| Calculated formula | C22 N4 S2 |
| SMILES | C1N(CCSC1)Cc1cc(cc(c2cc(cc(CN3CCSCC3)n2)C)n1)C |
| Title of publication | Synthesis and Characterization of Some New Bipyridyl-Based Multidentate Ligands and Their CuI Complexes |
| Authors of publication | Laitinen, Riitta H.; Csoban, Katalin; Pursiainen, Jouni; Huuskonen, Juhani; Rissanen, Kari |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1997 |
| Journal volume | 51 |
| Pages of publication | 462 - 469 |
| a | 9.1239 ± 0.0008 Å |
| b | 9.518 ± 0.002 Å |
| c | 7.3299 ± 0.0007 Å |
| α | 95.26 ± 0.09° |
| β | 107.805 ± 0.007° |
| γ | 112.17 ± 0.01° |
| Cell volume | 545.5 ± 0.3 Å3 |
| Ambient diffraction temperature | 296 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.074 |
| Weighted residual factors for significantly intense reflections | 0.092 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 247344 (current) | 2020-01-29 | cif/ Adding structures of 1557181 via cif-deposit CGI script. |
1557181.cif |
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Users of the data should acknowledge the original authors of the
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