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Information card for entry 4514272
Preview
| Coordinates | 4514272.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C75.5 H53 Co3 N12 O17 S2 |
|---|---|
| Calculated formula | C75.564 H52.782 Co3 N12 O16.798 S2 |
| Title of publication | Kinetic and Thermodynamic Control of Structure Transformations in a Family of Cobalt(II)-Organic Frameworks. |
| Authors of publication | Chen, Qiang; Feng, Rui; Xu, Jian; Jia, Yan-Yuan; Wang, Ting-Ting; Chang, Ze; Bu, Xian-He |
| Journal of publication | ACS applied materials & interfaces |
| Year of publication | 2017 |
| Journal volume | 9 |
| Journal issue | 40 |
| Pages of publication | 35141 - 35149 |
| a | 12.585 ± 0.003 Å |
| b | 17.882 ± 0.004 Å |
| c | 18 ± 0.004 Å |
| α | 100.378 ± 0.007° |
| β | 98.456 ± 0.009° |
| γ | 97.805 ± 0.006° |
| Cell volume | 3886 ± 1.5 Å3 |
| Cell temperature | 113 ± 2 K |
| Ambient diffraction temperature | 113 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1937 |
| Residual factor for significantly intense reflections | 0.1601 |
| Weighted residual factors for significantly intense reflections | 0.3682 |
| Weighted residual factors for all reflections included in the refinement | 0.3833 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 202559 (current) | 2017-11-04 | cif/ Adding structures of 4514267, 4514268, 4514269, 4514270, 4514271, 4514272, 4514273, 4514274, 4514275, 4514276 via cif-deposit CGI script. |
4514272.cif |
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Users of the data should acknowledge the original authors of the
structural data.