Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1573620
Preview
| Coordinates | 1573620.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | CuNDPA |
|---|---|
| Formula | C54 H67 Cu K N6 O9 |
| Calculated formula | C54 H67 Cu K N6 O9 |
| Title of publication | Self-sensitized Cu(ii)-complex catalyzed solar driven CO<sub>2</sub> reduction. |
| Authors of publication | Das, Soumadip; Roy, Aritra; Chakrabarti, Navonil; Mukhopadhyay, Narottam; Sarkar, Aniruddha; Sen Gupta, Sayam |
| Journal of publication | Chemical science |
| Year of publication | 2025 |
| Journal volume | 16 |
| Journal issue | 7 |
| Pages of publication | 3114 - 3123 |
| a | 9.0901 ± 0.0002 Å |
| b | 13.3962 ± 0.0002 Å |
| c | 22.3177 ± 0.0003 Å |
| α | 77.196 ± 0.001° |
| β | 86.431 ± 0.001° |
| γ | 82.887 ± 0.001° |
| Cell volume | 2628.01 ± 0.08 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100.15 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0409 |
| Residual factor for significantly intense reflections | 0.0373 |
| Weighted residual factors for significantly intense reflections | 0.101 |
| Weighted residual factors for all reflections included in the refinement | 0.1038 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298140 (current) | 2025-03-04 | cif/ Updating files of 1573620, 1573621 Original log message: Adding full bibliography for 1573620--1573621.cif. |
1573620.cif |
| 297244 | 2025-01-10 | cif/ Adding structures of 1573620, 1573621 via cif-deposit CGI script. |
1573620.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.