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Information card for entry 7064134
Preview
| Coordinates | 7064134.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H25 Fe N S |
|---|---|
| Calculated formula | C34 H25 Fe N S |
| Title of publication | Ferrocenyl-Functionalized Phenothiazine Conjugates: Structure-Property Relationship and Electrochemical Energy Storage Studies |
| Authors of publication | Misra, Rajneesh; Gupta, Deeksha; Tewari, Nikhil; Kandpal, Vivak; Singh, Prabal Pratap |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2025 |
| a | 9.6627 ± 0.0001 Å |
| b | 9.7006 ± 0.0001 Å |
| c | 14.0506 ± 0.0002 Å |
| α | 80.794 ± 0.001° |
| β | 77.605 ± 0.001° |
| γ | 85.91 ± 0.001° |
| Cell volume | 1268.82 ± 0.03 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0596 |
| Residual factor for significantly intense reflections | 0.044 |
| Weighted residual factors for significantly intense reflections | 0.1174 |
| Weighted residual factors for all reflections included in the refinement | 0.1267 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
| 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 |
|---|---|---|---|
| 303398 (current) | 2025-11-25 | cif/ Adding structures of 7064134 via cif-deposit CGI script. |
7064134.cif |
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Users of the data should acknowledge the original authors of the
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