Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7250605
Preview
| Coordinates | 7250605.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H22 N16 O10 |
|---|---|
| Calculated formula | C18 H22 N16 O10 |
| Title of publication | Constructing insensitive heat-resistant energetic materials via the hydrazo bridge mediated resonance-assisted hydrogen bonds |
| Authors of publication | Zhang, Xing; Pan, Linhu; Li, Min; Jing, Jianquan; Xia, Honglei; Zhang, Qinghua |
| Journal of publication | CrystEngComm |
| Year of publication | 2025 |
| a | 4.5534 ± 0.0005 Å |
| b | 11.8134 ± 0.001 Å |
| c | 12.2013 ± 0.0009 Å |
| α | 81.384 ± 0.007° |
| β | 88.616 ± 0.007° |
| γ | 81.965 ± 0.008° |
| Cell volume | 642.54 ± 0.1 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1354 |
| Residual factor for significantly intense reflections | 0.074 |
| Weighted residual factors for significantly intense reflections | 0.153 |
| Weighted residual factors for all reflections included in the refinement | 0.1774 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300281 (current) | 2025-07-02 | cif/ Adding structures of 7250605 via cif-deposit CGI script. |
7250605.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.