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Information card for entry 2021815
Preview
| Coordinates | 2021815.cif |
|---|---|
| Structure factors | 2021815.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[bis(2-amino-4-sulfonatobenzoato-κ<i>O</i>^1^)tetraaquatris{μ-1,4-bis[(imidazol-1-yl)methyl]benzene-κ^2^<i>N</i>^3^:<i>N</i>^3'^}dicobalt(II)] tetrahydrate] |
|---|---|
| Formula | C28 H34 Co N7 O9 S |
| Calculated formula | C28 H34 Co N7 O9 S |
| Title of publication | Band gap, sorption properties and fluorescence sensing behaviour of a novel 1D→2D cathenane-like cobalt(II)‒organic framework |
| Authors of publication | Zhang, Chong; Zhang, Qing-Hong; Zhang, Kou-Lin |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 12 |
| a | 10.8248 ± 0.001 Å |
| b | 21.331 ± 0.002 Å |
| c | 13.546 ± 0.0015 Å |
| α | 90° |
| β | 94.595 ± 0.003° |
| γ | 90° |
| Cell volume | 3117.8 ± 0.5 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0717 |
| Residual factor for significantly intense reflections | 0.04 |
| Weighted residual factors for significantly intense reflections | 0.0824 |
| Weighted residual factors for all reflections included in the refinement | 0.0928 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 227692 (current) | 2019-11-13 | cif/ hkl/ Adding structures of 2021815 via cif-deposit CGI script. |
2021815.cif 2021815.hkl |
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Users of the data should acknowledge the original authors of the
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