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Information card for entry 4349181
Preview
| Coordinates | 4349181.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H20 Cd N2 O4 S6 |
|---|---|
| Calculated formula | C23 H20 Cd N2 O4 S6 |
| Title of publication | Confinement Effects of Metal-Organic Framework on the Formation of Charge-Transfer Tetrathiafulvalene Dimers. |
| Authors of publication | Chen, Ting; Huo, Peng; Hou, Jin-Le; Xu, Jing; Zhu, Qin-Yu; Dai, Jie |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2016 |
| Journal volume | 55 |
| Journal issue | 24 |
| Pages of publication | 12758 - 12765 |
| a | 30.933 ± 0.008 Å |
| b | 7.3886 ± 0.0016 Å |
| c | 25.7 ± 0.007 Å |
| α | 90° |
| β | 111.909 ± 0.006° |
| γ | 90° |
| Cell volume | 5450 ± 2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.1822 |
| Residual factor for significantly intense reflections | 0.1225 |
| Weighted residual factors for significantly intense reflections | 0.1802 |
| Weighted residual factors for all reflections included in the refinement | 0.2048 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.194 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233673 (current) | 2019-11-23 | cif/ Adding structures of 4349181 via cif-deposit CGI script. |
4349181.cif |
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Users of the data should acknowledge the original authors of the
structural data.