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Information card for entry 1513213
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| Coordinates | 1513213.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Potassium Magnesium imide-amide |
|---|---|
| Chemical name | Potassium Magnesium imide-amide |
| Formula | D3 K Mg N2 |
| Calculated formula | D3 K Mg N2 |
| Title of publication | Corrigendum to Crystal structure solution of KMg(ND)(ND2): An ordered mixed amide/imide compound. |
| Authors of publication | Napolitano, Emilio; Dolci, Francesco; Campesi, Renato; Pistidda, Claudio; Hoelzel, Markus; Moretto, Pietro; Enzo, Stefano |
| Journal of publication | Int.J.Hydro.Eneg |
| Year of publication | 2014 |
| Journal volume | 39 |
| Pages of publication | 8181 - 8183 |
| a | 9.3497 ± 0.0003 Å |
| b | 3.6631 ± 0.0001 Å |
| c | 9.8901 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 338.725 ± 0.018 Å3 |
| Ambient diffraction temperature | 298 K |
| Ambient diffracton pressure | 101.325 kPa |
| Number of distinct elements | 4 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0271449 |
| Weighted residual factors for all reflections | 0.0355103 |
| Goodness-of-fit parameter for all reflections | 0.0111398 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | neutron |
| Diffraction radiation wavelength | 1.5482 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 211137 (current) | 2018-09-24 | cif/ Removing DOI prefixes from 127 CIF files using cif_fix_values r6433. |
1513213.cif |
| 176432 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
1513213.cif |
| 129598 | 2015-01-13 | cif/ Updating files of 1513213 Original log message: The authors want to remark that the crystal structure, KMg(ND)(ND2), originally described with an orthorhombic system with space group P212121 (n.19) in the article by Napolitano et al. [1], was recently reconsidered and the crystal model can be described in higher symmetry using the space group Pnma (n.62) [2]. As a consequence of the new symmetry: cell parameters, space group, and atomic coordinates have been updated. [1]Int J Hydrogen Energy 2014;39:868e76. [2]Int J Hydrogen Energy 2014;39:8181e83. |
1513213.cif |
| 91966 | 2014-01-06 | cif/ Adding structures of 1513213 via cif-deposit CGI script. |
1513213.cif |
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