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Information card for entry 4333085
Preview
Coordinates | 4333085.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | Ba39 Li80 N9 |
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Calculated formula | Ba39 Li80 N9 |
SMILES | [N].[Ba].[Ba].[Li].[Ba].[Li].[N].[Ba].[Ba].[Ba].[Li].[N].[Ba].[N].[Li].[Ba].[Ba].[Li].[Ba].[Li].[Ba].[Li].[Ba].[Li].[Li].[Li].[Li].[Ba].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[N].[Li].[Ba].[Ba].[Ba].[Li].[Ba].[Li].[Ba].[Li].[Li].[Ba].[Li].[Li].[Ba].[Li].[Ba].[Ba].[Li].[Ba].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[N].[Ba].[Li].[N].[Li].[N].[Li].[N].[Li].[Ba].[Ba].[Li].[Ba].[Ba].[Li].[Ba].[Ba].[Li].[Ba].[Li].[Ba].[Li].[Li].[Ba].[Li].[Li].[Ba].[Li].[Li].[Ba].[Li].[Li].[Ba].[Li].[Ba].[Ba].[Ba].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li].[Li] |
Title of publication | Li80Ba39N9: The First Li/Ba Subnitride |
Authors of publication | Smetana, Volodymyr; Babizhetskyy, Volodymyr; Vajenine, Grigori V.; Simon, Arndt |
Journal of publication | Inorganic Chemistry |
Year of publication | 2006 |
Journal volume | 45 |
Journal issue | 26 |
Pages of publication | 10786 - 10789 |
a | 16.0673 ± 0.0008 Å |
b | 16.0673 ± 0.0008 Å |
c | 32.267 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 8330 ± 0.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 3 |
Space group number | 121 |
Hermann-Mauguin space group symbol | I -4 2 m |
Hall space group symbol | I -4 2 |
Residual factor for all reflections | 0.0625 |
Residual factor for significantly intense reflections | 0.0395 |
Weighted residual factors for significantly intense reflections | 0.0854 |
Weighted residual factors for all reflections included in the refinement | 0.0934 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
Diffraction radiation wavelength | 0.56086 Å |
Diffraction radiation type | AgKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4333085.html
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