Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4518000
Preview
Coordinates | 4518000.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C74.94 H143.76 B Fe Mo N14 O0.56 P Si3 |
---|---|
Calculated formula | C74.938 H143.752 B Fe Mo N14 O0.562 P Si3 |
Title of publication | Stabilization of the Dinitrogen Analogue, Phosphorus Nitride. |
Authors of publication | Martinez, Jorge L.; Lutz, Sean A.; Beagan, Daniel M.; Gao, Xinfeng; Pink, Maren; Chen, Chun-Hsing; Carta, Veronica; Moënne-Loccoz, Pierre; Smith, Jeremy M. |
Journal of publication | ACS central science |
Year of publication | 2020 |
Journal volume | 6 |
Journal issue | 9 |
Pages of publication | 1572 - 1577 |
a | 15.5835 ± 0.0006 Å |
b | 15.7173 ± 0.0007 Å |
c | 20.184 ± 0.0009 Å |
α | 90.529 ± 0.001° |
β | 102.106 ± 0.001° |
γ | 114.564 ± 0.001° |
Cell volume | 4370.4 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 9 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1095 |
Residual factor for significantly intense reflections | 0.0713 |
Weighted residual factors for significantly intense reflections | 0.1808 |
Weighted residual factors for all reflections included in the refinement | 0.216 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4518000.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.