Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7128182
Preview
| Coordinates | 7128182.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C26 H19 Cl3 N2 O3 |
|---|---|
| Calculated formula | C26 H19 Cl3 N2 O3 |
| Title of publication | Practical access to fluorescent 2,3-naphthalimide derivatives via didehydro-Diels-Alder reaction. |
| Authors of publication | Chen, Xia; Zhong, Cheng; Lu, Yuling; Yao, Meng; Guan, Zhenhua; Chen, Chunmei; Zhu, Hucheng; Luo, Zengwei; Zhang, Yonghui |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2021 |
| Journal volume | 57 |
| Journal issue | 42 |
| Pages of publication | 5155 - 5158 |
| a | 7.0612 ± 0.0003 Å |
| b | 10.729 ± 0.0004 Å |
| c | 16.08 ± 0.0006 Å |
| α | 88.15 ± 0.002° |
| β | 87.486 ± 0.002° |
| γ | 84.532 ± 0.002° |
| Cell volume | 1211.02 ± 0.08 Å3 |
| Cell temperature | 297 ± 2 K |
| Ambient diffraction temperature | 297 ± 2 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 | 0.0623 |
| Residual factor for significantly intense reflections | 0.058 |
| Weighted residual factors for significantly intense reflections | 0.1612 |
| Weighted residual factors for all reflections included in the refinement | 0.167 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301860 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/12/ Each referenced PubChem compound corresponds to the full crystal structure. |
7128182.cif |
| 265865 | 2021-06-05 | cif/ Updating files of 7128182 Original log message: Adding full bibliography for 7128182.cif. |
7128182.cif |
| 264282 | 2021-04-18 | cif/ Adding structures of 7128182 via cif-deposit CGI script. |
7128182.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.