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Information card for entry 8104576
Preview
| Coordinates | 8104576.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H48 Cl2 N4 Ni O10 S2 |
|---|---|
| Calculated formula | C20 H48 Cl2 N4 Ni O10 S2 |
| Title of publication | Crystal structure of [meso-5,7,7,12,14,14,-hexamethyl-1,4,8,11-tetraazacyclotetradecane]nickel(II) diperchlorate – dimethylsulphoxide (1/2), C20H48Cl2N4NiO10S2 |
| Authors of publication | Rabi, Saswata; Dey, Lucky; Palit, Debashis; Dey, Benu Kumar; Rahman, Ismail M. M.; Tiekink, Edward R. T.; Roy, Tapashi Ghosh |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 6 |
| Pages of publication | 1243 - 1245 |
| a | 8.657 ± 0.002 Å |
| b | 15.233 ± 0.004 Å |
| c | 11.956 ± 0.003 Å |
| α | 90° |
| β | 102.737 ± 0.002° |
| γ | 90° |
| Cell volume | 1537.9 ± 0.7 Å3 |
| Cell temperature | 93 ± 2 K |
| Ambient diffraction temperature | 93 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0251 |
| Residual factor for significantly intense reflections | 0.0237 |
| Weighted residual factors for significantly intense reflections | 0.0648 |
| Weighted residual factors for all reflections included in the refinement | 0.0655 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273060 (current) | 2022-02-21 | cif/ Adding structures of 8104576 via cif-deposit CGI script. |
8104576.cif |
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Users of the data should acknowledge the original authors of the
structural data.