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Information card for entry 4345358
Preview
| Coordinates | 4345358.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C206 H444 Fe18 N45 O110.5 Tb6 |
|---|---|
| Calculated formula | C206 H423 Fe18 N45 O110.5 Tb6 |
| Title of publication | Ultralarge 3d/4f Coordination Wheels: From Carboxylate/Amino Alcohol-Supported {Fe4Ln2} to {Fe18Ln6} Rings. |
| Authors of publication | Botezat, Olga; van Leusen, Jan; Kravtsov, Victor Ch; Kögerler, Paul; Baca, Svetlana G. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2017 |
| Journal volume | 56 |
| Journal issue | 4 |
| Pages of publication | 1814 - 1822 |
| a | 15.7331 ± 0.0006 Å |
| b | 22.8661 ± 0.0008 Å |
| c | 24.5683 ± 0.0009 Å |
| α | 78.169 ± 0.001° |
| β | 81.104 ± 0.001° |
| γ | 78.161 ± 0.001° |
| Cell volume | 8408.1 ± 0.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.095 |
| Residual factor for significantly intense reflections | 0.0579 |
| Weighted residual factors for significantly intense reflections | 0.1463 |
| Weighted residual factors for all reflections included in the refinement | 0.171 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 192926 (current) | 2017-03-04 | cif/ Adding structures of 4345358 via cif-deposit CGI script. |
4345358.cif |
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