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Information card for entry 1551547
Preview
| Coordinates | 1551547.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H70 B2 Cl Fe O5 S5 |
|---|---|
| Calculated formula | C58 H70 B2 Cl Fe O5 S5 |
| Title of publication | Crystal Structure of a Mononuclear Iron(III) Complex, Chloridopentakis(dimethylsulfoxide-κ<i>O</i>)iron(III) Bis(tetraphenylborate) |
| Authors of publication | YOSHIDA, Kosuke; MITSUHASHI, Ryoji; MIKURIYA, Masahiro; SAKIYAMA, Hiroshi |
| Journal of publication | X-ray Structure Analysis Online |
| Year of publication | 2018 |
| Journal volume | 34 |
| Journal issue | 0 |
| Pages of publication | 1 |
| a | 10.4961 ± 0.0016 Å |
| b | 14.26 ± 0.002 Å |
| c | 19.166 ± 0.003 Å |
| α | 90° |
| β | 94.512 ± 0.002° |
| γ | 90° |
| Cell volume | 2859.8 ± 0.7 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1749 |
| Residual factor for significantly intense reflections | 0.1149 |
| Weighted residual factors for significantly intense reflections | 0.2605 |
| Weighted residual factors for all reflections included in the refinement | 0.293 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216157 (current) | 2019-06-20 | cif/ Adding structures of 1551547 via cif-deposit CGI script. |
1551547.cif |
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