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Information card for entry 4347780
Preview
| Coordinates | 4347780.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H24 N6 O4 |
|---|---|
| Calculated formula | C16 H24 N6 O4 |
| Title of publication | Pyrazinetetracarboxamide: A Duplex Ligand for Palladium(II). |
| Authors of publication | Lohrman, Jessica; Telikepalli, Hanumaiah; Johnson, Thomas S.; Jackson, Timothy A.; Day, Victor W.; Bowman-James, Kristin |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2016 |
| Journal volume | 55 |
| Journal issue | 11 |
| Pages of publication | 5098 - 5100 |
| a | 17.1327 ± 0.0012 Å |
| b | 23.4368 ± 0.0017 Å |
| c | 29.688 ± 0.002 Å |
| α | 109.215 ± 0.003° |
| β | 91.596 ± 0.003° |
| γ | 102.41 ± 0.002° |
| Cell volume | 10930.7 ± 1.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1051 |
| Residual factor for significantly intense reflections | 0.0628 |
| Weighted residual factors for significantly intense reflections | 0.183 |
| Weighted residual factors for all reflections included in the refinement | 0.2076 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 232499 (current) | 2019-11-23 | cif/ Adding structures of 4347780 via cif-deposit CGI script. |
4347780.cif |
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Users of the data should acknowledge the original authors of the
structural data.