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Information card for entry 7718754
Preview
| Coordinates | 7718754.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H32 F3 I4 Mn N4 O2 |
|---|---|
| Calculated formula | C36 H32 F3 I4 Mn N4 O2 |
| Title of publication | Halogen Bonds-enhanced Spin Dynamics: Investigating Co-crystallization Effects on Spin Crossover in Mononuclear Mn(III) Schiff-base Complexes |
| Authors of publication | Zhao, Sheng-Ze; Chen, Liwen; Zhu, Hai; Zhang, Hao-Zhe; Liu, Chang; Qin, Chun-Yan; Wang, Hai-Ying; Li, Yong-Hua; Wang, Shi |
| Journal of publication | Dalton Transactions |
| Year of publication | 2025 |
| a | 41.417 ± 0.009 Å |
| b | 15.289 ± 0.003 Å |
| c | 26.888 ± 0.007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 17026 ± 7 Å3 |
| Cell temperature | 294.62 K |
| Ambient diffraction temperature | 294.62 K |
| Number of distinct elements | 7 |
| Space group number | 43 |
| Hermann-Mauguin space group symbol | F d d 2 |
| Hall space group symbol | F 2 -2d |
| Residual factor for all reflections | 0.0712 |
| Residual factor for significantly intense reflections | 0.0513 |
| Weighted residual factors for significantly intense reflections | 0.1457 |
| Weighted residual factors for all reflections included in the refinement | 0.1632 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299721 (current) | 2025-05-18 | cif/ Adding structures of 7718751, 7718752, 7718753, 7718754, 7718755 via cif-deposit CGI script. |
7718754.cif |
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Users of the data should acknowledge the original authors of the
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