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Information card for entry 4345042
Preview
| Coordinates | 4345042.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C81 H102 Co3 K6 N12 O21 S9 |
|---|---|
| Calculated formula | C81 H102 Co3 K6 N12 O21 S9 |
| Title of publication | Modulating the Primary and Secondary Coordination Spheres within a Series of Co(II)-OH Complexes. |
| Authors of publication | Jones, Jason R.; Ziller, Joseph W.; Borovik, A. S. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2017 |
| Journal volume | 56 |
| Journal issue | 3 |
| Pages of publication | 1112 - 1120 |
| a | 19.4569 ± 0.0014 Å |
| b | 32.796 ± 0.002 Å |
| c | 18.3948 ± 0.0013 Å |
| α | 90° |
| β | 111.204 ± 0.0009° |
| γ | 90° |
| Cell volume | 10943.2 ± 1.3 Å3 |
| Cell temperature | 88 ± 2 K |
| Ambient diffraction temperature | 88 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0973 |
| Residual factor for significantly intense reflections | 0.0821 |
| Weighted residual factors for significantly intense reflections | 0.2025 |
| Weighted residual factors for all reflections included in the refinement | 0.2138 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 193459 (current) | 2017-03-04 | cif/ Updating files of 4345041, 4345042 Original log message: Adding full bibliography for 4345041--4345042.cif. |
4345042.cif |
| 190604 | 2017-01-18 | cif/ Adding structures of 4345042 via cif-deposit CGI script. |
4345042.cif |
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Users of the data should acknowledge the original authors of the
structural data.