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Information card for entry 1551730
Preview
| Coordinates | 1551730.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H14 I2 N2 O8 |
|---|---|
| Calculated formula | C12 H14 I2 N2 O8 |
| SMILES | c1cccc[n+]1CC[n+]1ccccc1.[O-][I](=O)(=O)=O.[I](=O)(=O)(=O)[O-] |
| Title of publication | Synthesis and Crystal Structure of Bis pyridinium 1,2-Ethane periodate |
| Authors of publication | GHOLIZADEH, Mostafa; HOJATI, Seyyedeh Fatemeh; POURAYOUBI, Mehrdad; MALEKI, Behrooz; KIA, Mehdi; NOTASH, Behrouz |
| Journal of publication | X-ray Structure Analysis Online |
| Year of publication | 2011 |
| Journal volume | 27 |
| Pages of publication | 47 |
| a | 6.2405 ± 0.0012 Å |
| b | 7.2635 ± 0.0015 Å |
| c | 10.1 ± 0.002 Å |
| α | 100.02 ± 0.03° |
| β | 94.59 ± 0.03° |
| γ | 100.02 ± 0.03° |
| Cell volume | 441.07 ± 0.17 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0772 |
| Residual factor for significantly intense reflections | 0.0581 |
| Weighted residual factors for significantly intense reflections | 0.1732 |
| Weighted residual factors for all reflections included in the refinement | 0.2452 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.164 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216342 (current) | 2019-06-20 | cif/ Adding structures of 1551730 via cif-deposit CGI script. |
1551730.cif |
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Users of the data should acknowledge the original authors of the
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