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Information card for entry 7117859
Preview
| Coordinates | 7117859.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H16 Cr2 N4 Ni O7 |
|---|---|
| Calculated formula | C24 H16 Cr2 N4 Ni O7 |
| Title of publication | Novel mode of 2-fold interpenetration observed in a primitive cubic network of formula [Ni(1,2-bis(4-pyridyl)acetylene)2(Cr2O7)]n |
| Authors of publication | Hayley S. Scott; Alankriti Bajpai; Kai-Jie Chen; Tony Pham; Brian Space; John J. Perry,IV; Michael J. Zaworotko |
| Journal of publication | Chem.Commun. |
| Year of publication | 2015 |
| Journal volume | 51 |
| Pages of publication | 14832 |
| a | 8.5465 ± 0.0009 Å |
| b | 15.9683 ± 0.0017 Å |
| c | 20.726 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2828.5 ± 0.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100.15 K |
| Number of distinct elements | 6 |
| Space group number | 23 |
| Hermann-Mauguin space group symbol | I 2 2 2 |
| Hall space group symbol | I 2 2 |
| Residual factor for all reflections | 0.1902 |
| Residual factor for significantly intense reflections | 0.0956 |
| Weighted residual factors for significantly intense reflections | 0.204 |
| Weighted residual factors for all reflections included in the refinement | 0.2406 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.982 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 158311 (current) | 2015-09-25 | cif/ Adding structures of 7117859 via cif-deposit CGI script. |
7117859.cif |
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