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Information card for entry 2241204
Preview
| Coordinates | 2241204.cif |
|---|---|
| Structure factors | 2241204.hkl |
| Original paper (by DOI) | HTML |
| Common name | Phosphorus oxonitride |
|---|---|
| Chemical name | Phosphorus oxonitride |
| Formula | N O P |
| Calculated formula | N O P |
| Title of publication | Crystal structures of cristobalite-type and coesite-type PON redetermined on the basis of single-crystal X-ray diffraction data |
| Authors of publication | Bykov, Maxim; Bykova, Elena; Dyadkin, Vadim; Baumann, Dominik; Schnick, Wolfgang; Dubrovinsky, Leonid; Dubrovinskaia, Natalia |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 11 |
| Pages of publication | 1325 - 1327 |
| a | 4.6135 ± 0.0002 Å |
| b | 4.6135 ± 0.0002 Å |
| c | 6.9991 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 148.972 ± 0.014 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 3 |
| Space group number | 122 |
| Hermann-Mauguin space group symbol | I -4 2 d |
| Hall space group symbol | I -4 2bw |
| Residual factor for all reflections | 0.0159 |
| Residual factor for significantly intense reflections | 0.0159 |
| Weighted residual factors for significantly intense reflections | 0.0429 |
| Weighted residual factors for all reflections included in the refinement | 0.0429 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.453 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181913 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/12. |
2241204.cif 2241204.hkl |
| 167931 | 2015-10-14 | cif/ hkl/ Adding structures of 2241203, 2241204 via cif-deposit CGI script. |
2241204.cif 2241204.hkl |
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Users of the data should acknowledge the original authors of the
structural data.