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Information card for entry 7238993
Preview
| Coordinates | 7238993.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C37 H33 N9 Ni O S2 |
|---|---|
| Calculated formula | C37 H33 N9 Ni O S2 |
| Title of publication | Synthesis, crystal structure and bio-macromolecular interaction studies of pyridine-based thiosemicarbazone and its Ni(ii) and Cu(ii) complexes |
| Authors of publication | Basu, Arghya; Thiyagarajan, Durairaj; Kar, Chirantan; Ramesh, Aiyagari; Das, Gopal |
| Journal of publication | RSC Advances |
| Year of publication | 2013 |
| Journal volume | 3 |
| Journal issue | 33 |
| Pages of publication | 14088 |
| a | 9.0267 ± 0.001 Å |
| b | 33.436 ± 0.003 Å |
| c | 12.2036 ± 0.0011 Å |
| α | 90° |
| β | 100.916 ± 0.006° |
| γ | 90° |
| Cell volume | 3616.6 ± 0.6 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.2287 |
| Residual factor for significantly intense reflections | 0.0879 |
| Weighted residual factors for significantly intense reflections | 0.2039 |
| Weighted residual factors for all reflections included in the refinement | 0.206 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.857 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244501 (current) | 2019-11-28 | cif/ Adding structures of 7238992, 7238993, 7238994 via cif-deposit CGI script. |
7238993.cif |
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Users of the data should acknowledge the original authors of the
structural data.