Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7207553
Preview
Coordinates | 7207553.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (2,2'-Bipyridine)(Succinic acid) |
---|---|
Chemical name | 2,2'-Bipyridine Succinic acid (1/1) |
Formula | C14 H14 N2 O4 |
Calculated formula | C14 H14 N2 O4 |
SMILES | c1(ncccc1)c1ccccn1.C(C(=O)O)CC(=O)O |
Title of publication | Screening for cocrystals of succinic acid and 4-aminobenzoic acid |
Authors of publication | Issa, Nizar; Barnett, Sarah A.; Mohamed, Sharmarke; Braun, Doris E.; Copley, Royston C. B.; Tocher, Derek A.; Price, Sarah L. |
Journal of publication | CrystEngComm |
Year of publication | 2012 |
Journal volume | 14 |
Journal issue | 7 |
Pages of publication | 2454 |
a | 8.958 ± 0.003 Å |
b | 5.1788 ± 0.0014 Å |
c | 14.357 ± 0.004 Å |
α | 90° |
β | 106.109 ± 0.004° |
γ | 90° |
Cell volume | 639.9 ± 0.3 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0486 |
Residual factor for significantly intense reflections | 0.0391 |
Weighted residual factors for significantly intense reflections | 0.0976 |
Weighted residual factors for all reflections included in the refinement | 0.1017 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
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/7207553.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.