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Information card for entry 7063869
Preview
| Coordinates | 7063869.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H44 Co N5 P2 S4 |
|---|---|
| Calculated formula | C42 H44 Co N5 P2 S4 |
| Title of publication | New 1,2- bis(diphenylphosphino)ethane-Laden Co(III) Dithiolate Anions: Dithiolate-Mediated Tuning of Electrocatalytic Performance for Non- Aqueous Hydrogen Evolution Reaction |
| Authors of publication | Srivastava, Shreya; Srivastava, Devyani; Kushwaha, Aparna; Omoding, Daniel; Kociok-Köhn, Gabriele; Kumar, Abhinav |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2025 |
| a | 15.4218 ± 0.0002 Å |
| b | 37.1781 ± 0.0005 Å |
| c | 46.2728 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 26530.7 ± 0.6 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 0.2 K |
| Number of distinct elements | 6 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.1022 |
| Residual factor for significantly intense reflections | 0.0696 |
| Weighted residual factors for significantly intense reflections | 0.1425 |
| Weighted residual factors for all reflections included in the refinement | 0.1605 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300250 (current) | 2025-06-28 | cif/ Adding structures of 7063869 via cif-deposit CGI script. |
7063869.cif |
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