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Information card for entry 7714229
Preview
| Coordinates | 7714229.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C65 H44 Cl6 Fe2 N6 O9 |
|---|---|
| Calculated formula | C65 H44 Cl6 Fe2 N6 O9 |
| Title of publication | Closed-shell Phenalenyl-based Dinuclear Iron(III) Complex as a Robust Cathode for One-Compartment H2O2 Fuel Cell |
| Authors of publication | Kamboj, Nisha; Dey, Ayan; Lama, Prem; Majumder, Moumita; Sengupta, Srijan; Metre, Ramesh K. |
| Journal of publication | Dalton Transactions |
| Year of publication | 2023 |
| a | 23.246 ± 0.0012 Å |
| b | 13.2054 ± 0.0007 Å |
| c | 19.6226 ± 0.001 Å |
| α | 90° |
| β | 101.358 ± 0.002° |
| γ | 90° |
| Cell volume | 5905.6 ± 0.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.099 |
| Residual factor for significantly intense reflections | 0.0797 |
| Weighted residual factors for significantly intense reflections | 0.1928 |
| Weighted residual factors for all reflections included in the refinement | 0.2043 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286967 (current) | 2023-10-14 | cif/ Adding structures of 7714229, 7714230 via cif-deposit CGI script. |
7714229.cif |
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