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Information card for entry 2312504
Preview
| Coordinates | 2312504.cif |
|---|---|
| Structure factors | 2312504.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(4'-phenyl-2,2':6',2''-terpyridine)manganese(II) bis(perchlorate) |
|---|---|
| Formula | C42 H30 Cl2 Mn N6 O8 |
| Calculated formula | C42 H30 Cl2 Mn N6 O8 |
| Title of publication | Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals. |
| Authors of publication | Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto |
| Journal of publication | Acta crystallographica. Section C, Structural chemistry |
| Year of publication | 2024 |
| Journal volume | 80 |
| Journal issue | 6 |
| a | 9.51026 ± 0.00018 Å |
| b | 12.5149 ± 0.0002 Å |
| c | 31.2962 ± 0.0006 Å |
| α | 90° |
| β | 96.878 ± 0.0018° |
| γ | 90° |
| Cell volume | 3698.07 ± 0.12 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 99.99 ± 0.1 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 | 0.0384 |
| Residual factor for significantly intense reflections | 0.0309 |
| Weighted residual factors for significantly intense reflections | 0.0793 |
| Weighted residual factors for all reflections included in the refinement | 0.0837 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291899 (current) | 2024-05-17 | cif/ hkl/ Adding structures of 2312503, 2312504, 2312505 via cif-deposit CGI script. |
2312504.cif 2312504.hkl |
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Users of the data should acknowledge the original authors of the
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