Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7160204
Preview
| Coordinates | 7160204.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H23 Cl3 N2 O7 |
|---|---|
| Calculated formula | C34 H23 Cl3 N2 O7 |
| Title of publication | Iridium-catalyzed tandem olefination/aza-Michael reaction: rapid access to N-N functionalized hydrazides |
| Authors of publication | Dong, Lin; Zhang, Chao |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2024 |
| a | 11.4075 ± 0.0001 Å |
| b | 12.0938 ± 0.0001 Å |
| c | 13.1116 ± 0.0001 Å |
| α | 81.557 ± 0.001° |
| β | 67.569 ± 0.001° |
| γ | 73.629 ± 0.001° |
| Cell volume | 1602.65 ± 0.03 Å3 |
| Cell temperature | 300.57 ± 0.1 K |
| Ambient diffraction temperature | 300.57 ± 0.1 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 | 0.0544 |
| Residual factor for significantly intense reflections | 0.0515 |
| Weighted residual factors for significantly intense reflections | 0.1424 |
| Weighted residual factors for all reflections included in the refinement | 0.145 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.106 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295768 (current) | 2024-11-05 | cif/ Adding structures of 7160204 via cif-deposit CGI script. |
7160204.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.