Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1548317
Preview
| Coordinates | 1548317.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H12 Cu N4 O5 |
|---|---|
| Calculated formula | C8 H12 Cu N4 O5 |
| Title of publication | Femtolitre chemistry assisted by microfluidic pen lithography |
| Authors of publication | Carlos Carbonell; Kyriakos C. Stylianou; Jordi Hernando; Emi Evangelio; Sarah A. Barnett; Saju Nettikadan; Inhar Imaz; Daniel Maspoch |
| Journal of publication | Nature Communications |
| Year of publication | 2013 |
| Journal volume | 4 |
| Pages of publication | 2173 |
| a | 6.991 ± 0.005 Å |
| b | 10.778 ± 0.005 Å |
| c | 15.575 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1173.6 ± 1.1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.1272 |
| Residual factor for significantly intense reflections | 0.069 |
| Weighted residual factors for significantly intense reflections | 0.1471 |
| Weighted residual factors for all reflections included in the refinement | 0.1805 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.913 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 203780 (current) | 2017-11-29 | cif/ Adding structures of 1548317 via cif-deposit CGI script. |
1548317.cif |
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.