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Information card for entry 1556601
Preview
Coordinates | 1556601.cif |
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Original paper (by DOI) | HTML |
Formula | C56 H80 N32 S8 Zn4 |
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Calculated formula | C56 H80 N32 S8 Zn4 |
Title of publication | [2 x 2] Molecular Grids of Ni(II) and Zn(II) with Redox-Active 1,4-Pyrazine-Bis(thiosemicarbazone) Ligands |
Authors of publication | Arefyeva, N.; Sandleben, A.; Krest, A.; Baumann, U.; Schafer, M.; Kempf, M.; Klein, A. |
Journal of publication | Inorganics |
Year of publication | 2018 |
Journal volume | 6 |
Pages of publication | 51 |
a | 19.78 ± 0.001 Å |
b | 19.78 ± 0.001 Å |
c | 20.291 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7938.8 ± 0.7 Å3 |
Cell temperature | 170 ± 2 K |
Ambient diffraction temperature | 170 ± 2 K |
Number of distinct elements | 5 |
Space group number | 97 |
Hermann-Mauguin space group symbol | I 4 2 2 |
Hall space group symbol | I 4 2 |
Residual factor for all reflections | 0.2583 |
Residual factor for significantly intense reflections | 0.1616 |
Weighted residual factors for significantly intense reflections | 0.3933 |
Weighted residual factors for all reflections included in the refinement | 0.4359 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.145 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
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245239 (current) | 2019-12-17 | cif/ Adding structures of 1556601 via cif-deposit CGI script. |
1556601.cif |
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