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Information card for entry 1558003
Preview
Coordinates | 1558003.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C72 H74 K2 N2 Ni4 O14 S12 |
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Calculated formula | C72 H74 K2 N2 Ni4 O14 S12 |
Title of publication | A Mixed-Valence Tetra-Nuclear Nickel Dithiolene Complex: Synthesis, Crystal Structure, and the Lability of Its Nickel Sulfur Bonds |
Authors of publication | Ahmadi, Mohsen; Correia, Jevy; Chrysochos, Nicolas; Schulzke, Carola |
Journal of publication | Inorganics |
Year of publication | 2020 |
Journal volume | 8 |
Journal issue | 4 |
Pages of publication | 27 |
a | 13.588 ± 0.003 Å |
b | 19.062 ± 0.004 Å |
c | 16.764 ± 0.003 Å |
α | 90° |
β | 100.11 ± 0.03° |
γ | 90° |
Cell volume | 4274.7 ± 1.6 Å3 |
Cell temperature | 170 ± 2 K |
Ambient diffraction temperature | 170 ± 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 | 0.1006 |
Residual factor for significantly intense reflections | 0.0568 |
Weighted residual factors for significantly intense reflections | 0.1466 |
Weighted residual factors for all reflections included in the refinement | 0.1668 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.921 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
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251747 (current) | 2020-05-05 | cif/ Adding structures of 1558003 via cif-deposit CGI script. |
1558003.cif |
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