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Information card for entry 7710688
Preview
| Coordinates | 7710688.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H23 Fe N3 O3 |
|---|---|
| Calculated formula | C29 H23 Fe N3 O3 |
| Title of publication | Ferrocene-appended Anthraquinone and Coumarin as Redox-active Cytotoxins |
| Authors of publication | Houshmand, Aryan; Heroux, Devon; Liu, Dennis; Zhou, Wen; Linington, Roger Gareth; Bally, Marcel; Warren, Jeffrey J.; Walsby, Charles John |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 9.5846 ± 0.0011 Å |
| b | 10.9289 ± 0.0012 Å |
| c | 12.3271 ± 0.0014 Å |
| α | 96.266 ± 0.002° |
| β | 104.325 ± 0.002° |
| γ | 106.238 ± 0.002° |
| Cell volume | 1178.9 ± 0.2 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.0813 |
| Residual factor for significantly intense reflections | 0.0486 |
| Weighted residual factors for significantly intense reflections | 0.0887 |
| Weighted residual factors for all reflections included in the refinement | 0.0977 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 276581 (current) | 2022-07-06 | cif/ Adding structures of 7710688, 7710689 via cif-deposit CGI script. |
7710688.cif |
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Users of the data should acknowledge the original authors of the
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