Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1564044
Preview
Coordinates | 1564044.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C13 H19 N2 Na O4 |
---|---|
Calculated formula | C13 H19 N2 Na O4 |
Title of publication | Homochiral imidazolium-based dicarboxylate compounds: Structure and solution behaviour |
Authors of publication | Caballero, Pedro; Colodrero, Rosario M.P.; Conejo, María del Mar; Pastor, Antonio; Álvarez, Eleuterio; Montilla, Francisco; Carrasco, Carlos J.; Nicasio, Antonio I.; Galindo, Agustín |
Journal of publication | Inorganica Chimica Acta |
Year of publication | 2020 |
Journal volume | 513 |
Pages of publication | 119923 |
a | 10.7327 ± 0.0006 Å |
b | 10.7327 ± 0.0006 Å |
c | 12.6277 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1454.6 ± 0.16 Å3 |
Cell temperature | 213 ± 2 K |
Ambient diffraction temperature | 213 ± 2 K |
Number of distinct elements | 5 |
Space group number | 76 |
Hermann-Mauguin space group symbol | P 41 |
Hall space group symbol | P 4w |
Residual factor for all reflections | 0.0307 |
Residual factor for significantly intense reflections | 0.0297 |
Weighted residual factors for significantly intense reflections | 0.0819 |
Weighted residual factors for all reflections included in the refinement | 0.0824 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
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/1564044.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.