Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1551614
Preview
Coordinates | 1551614.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | acedoben-dimepranol (4:2) |
---|---|
Chemical name | 4-acetamidobenzoic acid - N,N-dimethylamino-2-propanol (4:2) |
Formula | C23 H31 N3 O7 |
Calculated formula | C23 H31 N3 O7 |
Title of publication | Drug-drug Multi-component Crystal of Acedoben‒Dimepranol 2:1 |
Authors of publication | YOSHIDA, Tomomi; UMEDA, Daiki; PUTRA, Okky Dwichandra; UEKUSA, Hidehiro; YONEMOCHI, Etsuo |
Journal of publication | X-ray Structure Analysis Online |
Year of publication | 2016 |
Journal volume | 32 |
Journal issue | 0 |
Pages of publication | 39 |
a | 7.78174 ± 0.00014 Å |
b | 9.71395 ± 0.00018 Å |
c | 63.5236 ± 0.0012 Å |
α | 90° |
β | 92.4271 ± 0.0007° |
γ | 90° |
Cell volume | 4797.53 ± 0.15 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0565 |
Residual factor for significantly intense reflections | 0.0443 |
Weighted residual factors for significantly intense reflections | 0.1241 |
Weighted residual factors for all reflections included in the refinement | 0.1319 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.255 |
Diffraction radiation wavelength | 1.54186 Å |
Diffraction radiation type | CuKα |
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/1551614.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.