Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7247491
Preview
Coordinates | 7247491.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | N-methyl-N-propylpyrrolidinium (tetrakis)trifluoroethoxy borate |
---|---|
Formula | C16 H26 B F12 N O4 |
Calculated formula | C16 H26 B F12 N O4 |
Title of publication | Fluoroborate ionic liquids as sodium battery electrolytes. |
Authors of publication | Duncan, Dale T.; Piper, Samantha L.; Forsyth, Maria; MacFarlane, Douglas R.; Kar, Mega |
Journal of publication | Physical chemistry chemical physics : PCCP |
Year of publication | 2023 |
Journal volume | 25 |
Journal issue | 40 |
Pages of publication | 27718 - 27730 |
a | 17.6281 ± 0.0002 Å |
b | 18.6841 ± 0.0002 Å |
c | 28.371 ± 0.0003 Å |
α | 90° |
β | 96.401 ± 0.001° |
γ | 90° |
Cell volume | 9286.17 ± 0.18 Å3 |
Cell temperature | 123.15 K |
Ambient diffraction temperature | 123.15 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1351 |
Residual factor for significantly intense reflections | 0.1216 |
Weighted residual factors for significantly intense reflections | 0.3503 |
Weighted residual factors for all reflections included in the refinement | 0.3587 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/7247491.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.