Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7043941
Preview
| Coordinates | 7043941.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | cothio |
|---|---|
| Formula | C36 H34 Co N6 O9 S |
| Calculated formula | C36 H34 Co N6 O9 S |
| Title of publication | Magnetic Diversity in Three-dimensional 2-Fold Interpenetrated Structure: Story of Two Compounds |
| Authors of publication | Mandal, Sukhendu; Rao, Purnachandra; chaudhary, Sonu Pratap; Arjun, U.; Kuznetsov, Denis; Nath, Ramesh Chandra |
| Journal of publication | Dalton Trans. |
| Year of publication | 2017 |
| a | 15.4896 ± 0.0005 Å |
| b | 18.1048 ± 0.0005 Å |
| c | 24.9836 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7006.3 ± 0.4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0858 |
| Residual factor for significantly intense reflections | 0.0431 |
| Weighted residual factors for significantly intense reflections | 0.0971 |
| Weighted residual factors for all reflections included in the refinement | 0.1201 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.915 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 199690 (current) | 2017-08-10 | cif/ Adding structures of 7043941, 7043942 via cif-deposit CGI script. |
7043941.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.