Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4507621
Preview
Coordinates | 4507621.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 1-Cyclopropyl-7-(4-ethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-4-oxo-3- quinolonecarboxylic acid hexahydrate |
---|---|
Formula | C19 H34 F N3 O9 |
Calculated formula | C19 H34 F N3 O9 |
Title of publication | Structural Landscape of Pure Enrofloxacin and Its Novel Salts: Enhanced Solubility for Better Pharmaceutical Applicability |
Authors of publication | Karanam, Maheswararao; Choudhury, Angshuman Roy |
Journal of publication | Crystal Growth & Design |
Year of publication | 2013 |
Journal volume | 13 |
Journal issue | 4 |
Pages of publication | 1626 |
a | 8.037 ± 0.003 Å |
b | 11.03 ± 0.008 Å |
c | 13.186 ± 0.008 Å |
α | 79.17 ± 0.005° |
β | 78.873 ± 0.01° |
γ | 88.102 ± 0.01° |
Cell volume | 1126.5 ± 1.1 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1582 |
Residual factor for significantly intense reflections | 0.0777 |
Weighted residual factors for significantly intense reflections | 0.2027 |
Weighted residual factors for all reflections included in the refinement | 0.2523 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
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/4507621.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.