Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7710002
Preview
| Coordinates | 7710002.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H24 N6 Ni O4 S0.98 |
|---|---|
| Calculated formula | C6 H24 N6 Ni O3.9996 S0.981 |
| Title of publication | A series of dynamic single crystals of [MII(en)3]SO4 (M = Ni , Mn, Cd) shows tunable dielectric property and anisotropic thermal expansion |
| Authors of publication | Wu, Cong; Gao, Kaige; Yao, Zi-Shuo; Tao, Jun |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 8.9389 ± 0.0005 Å |
| b | 8.9389 ± 0.0005 Å |
| c | 9.6152 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 665.36 ± 0.06 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 163 |
| Hermann-Mauguin space group symbol | P -3 1 c |
| Hall space group symbol | -P 3 2c |
| Residual factor for all reflections | 0.0318 |
| Residual factor for significantly intense reflections | 0.0299 |
| Weighted residual factors for significantly intense reflections | 0.0756 |
| Weighted residual factors for all reflections included in the refinement | 0.0764 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.165 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274465 (current) | 2022-04-12 | cif/ Adding structures of 7710002, 7710003, 7710004, 7710005, 7710006, 7710007 via cif-deposit CGI script. |
7710002.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.