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Information card for entry 1561366
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 1561366.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | B3 Ba2 Cs2 Li3 O24 P6 |
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Calculated formula | B3 Ba2 Cs2 Li3 O24 P6 |
Title of publication | Syntheses of six and twelve membered borophosphate ring structure with nonlinear optical activity |
Authors of publication | Khan, Muhammad Ali; Li, Yan-Yan; Lin, Hua; Zhang, Li-Jun; Liu, Peng-Fei; Zhao, Hua-Jun; Duan, Rui-Huan; Wang, Jin-Qiu; Chen, Ling |
Journal of publication | Journal of Solid State Chemistry |
Year of publication | 2016 |
Journal volume | 243 |
Pages of publication | 259 - 266 |
a | 12.853 ± 0.0005 Å |
b | 12.853 ± 0.0005 Å |
c | 12.853 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2123.31 ± 0.14 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 198 |
Hermann-Mauguin space group symbol | P 21 3 |
Hall space group symbol | P 2ac 2ab 3 |
Residual factor for all reflections | 0.0295 |
Residual factor for significantly intense reflections | 0.0292 |
Weighted residual factors for significantly intense reflections | 0.0783 |
Weighted residual factors for all reflections included in the refinement | 0.0785 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/1561366.html
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Users of the data should acknowledge the original authors of the
structural data.