Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7240871
Preview
| Coordinates | 7240871.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Imipenem monohydrate |
|---|---|
| Formula | C12 H19 N3 O5 S |
| Calculated formula | C12 H19 N3 O5 S |
| Title of publication | Disappearing Disorder |
| Authors of publication | Dittrich, Birger; Sever, Christoph; Luebben, Jens |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| a | 8.1964 ± 0.0003 Å |
| b | 11.0921 ± 0.0004 Å |
| c | 15.3137 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1392.25 ± 0.09 Å3 |
| 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 | 0.053 |
| Residual factor for significantly intense reflections | 0.041 |
| Weighted residual factors for all reflections included in the refinement | 0.061 |
| Goodness-of-fit parameter for all reflections included in the refinement | 2.136 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288642 (current) | 2024-01-03 | Changed data name '_iucr_instruction_details' to '_iucr_refine_instructions_details' in multiple entries. |
7240871.cif |
| 254329 | 2020-07-16 | cif/ Adding structures of 7240869, 7240870, 7240871, 7240872, 7240873, 7240874, 7240875, 7240876, 7240877, 7240878, 7240879, 7240880, 7240881, 7240882 via cif-deposit CGI script. |
7240871.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.