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Information card for entry 7049991
Preview
| Coordinates | 7049991.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C109.5 H87 Cl11 F6 N20 Ni5 O8 P S4 |
|---|---|
| Calculated formula | C109.5 H87 Cl11 F6 N20 Ni5 O8 P S4 |
| Title of publication | Ligand Effects on the Structure, Mixed-valence Sites and Magnetic Properties of Novel Pentanickel String Complexes |
| Authors of publication | Chiu, Cheng-Chang; Lee, Gene-Hsiang; Lin, Tien-Sung; Peng, Shie-Ming |
| Journal of publication | Dalton Transactions |
| Year of publication | 2019 |
| a | 16.422 ± 0.0007 Å |
| b | 16.8719 ± 0.0008 Å |
| c | 22.4552 ± 0.001 Å |
| α | 73.637 ± 0.0014° |
| β | 76.3465 ± 0.0016° |
| γ | 76.099 ± 0.0018° |
| Cell volume | 5699.4 ± 0.4 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0927 |
| Residual factor for significantly intense reflections | 0.0696 |
| Weighted residual factors for significantly intense reflections | 0.1867 |
| Weighted residual factors for all reflections included in the refinement | 0.2046 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 214997 (current) | 2019-05-09 | cif/ Adding structures of 7049990, 7049991, 7049992, 7049993, 7049994, 7049995, 7049996, 7049997 via cif-deposit CGI script. |
7049991.cif |
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Users of the data should acknowledge the original authors of the
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