Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7044326
Preview
| Coordinates | 7044326.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H32 N6 O11 Zn2 |
|---|---|
| Calculated formula | C40 H32 N6 O11.3333 Zn2 |
| Title of publication | A pair of 3D enantiotopic zinc(II) complexes based on two asymmetric achiral ligands |
| Authors of publication | Zhang, Mingdao; Li, Yan-Le; Shi, Zhen-Zhen; Ma, Jing; Zheng, Hegen |
| Journal of publication | Dalton Trans. |
| Year of publication | 2017 |
| a | 33.3064 ± 0.001 Å |
| b | 33.3064 ± 0.001 Å |
| c | 9.5764 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 9200 ± 0.7 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 146 |
| Hermann-Mauguin space group symbol | R 3 :H |
| Hall space group symbol | R 3 |
| Residual factor for all reflections | 0.0632 |
| Residual factor for significantly intense reflections | 0.0572 |
| Weighted residual factors for significantly intense reflections | 0.1602 |
| Weighted residual factors for all reflections included in the refinement | 0.165 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 201330 (current) | 2017-09-27 | cif/ Adding structures of 7044326, 7044327 via cif-deposit CGI script. |
7044326.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.