Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7707175
Preview
| Coordinates | 7707175.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C36 H32 Fe N6 O6 S4 |
|---|---|
| Calculated formula | C36 H32 Fe N6 O6 S4 |
| Title of publication | Thermo- and photoinduced spin state switching in an iron(II) 2D coordination network associated with large light-induced thermal hysteresis and tuning of dimensionality <i>via</i> ligand modulation. |
| Authors of publication | Ghosh, Subrata; Kamilya, Sujit; Pramanik, Titas; Mohanty, Ashutosh; Rouzières, Mathieu; Herchel, Radovan; Mehta, Sakshi; Mondal, Abhishake |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2021 |
| Journal volume | 50 |
| Journal issue | 22 |
| Pages of publication | 7725 - 7735 |
| a | 19.6279 ± 0.0004 Å |
| b | 7.76 ± 0.0002 Å |
| c | 26.5705 ± 0.0006 Å |
| α | 90° |
| β | 95.245 ± 0.002° |
| γ | 90° |
| Cell volume | 4030.07 ± 0.16 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | I 1 2/a 1 |
| Hall space group symbol | -I 2ya |
| Residual factor for all reflections | 0.0408 |
| Residual factor for significantly intense reflections | 0.0361 |
| Weighted residual factors for significantly intense reflections | 0.0891 |
| Weighted residual factors for all reflections included in the refinement | 0.0924 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7707175.cif |
| 267159 | 2021-07-05 | cif/ Updating files of 7707175, 7707176, 7707177, 7707178 Original log message: Adding full bibliography for 7707175--7707178.cif. |
7707175.cif |
| 264437 | 2021-04-23 | cif/ Adding structures of 7707175, 7707176, 7707177, 7707178 via cif-deposit CGI script. |
7707175.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.