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Information card for entry 7712110
Preview
| Coordinates | 7712110.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C87 H129 N6 O3 Sm |
|---|---|
| Calculated formula | C87 H129 N6 O3 Sm |
| Title of publication | Formation of a cyclooctatetraenylsamarium(III) inverse sandwich that ring-opens tetrahydrofuran. |
| Authors of publication | Peedika Paramban, Ramees; Guo, Zhifang; Deacon, Glen B.; Junk, Peter C. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2023 |
| a | 12.6902 ± 0.0004 Å |
| b | 17.9896 ± 0.0007 Å |
| c | 20.6655 ± 0.0004 Å |
| α | 97.357 ± 0.002° |
| β | 103.624 ± 0.002° |
| γ | 108.342 ± 0.003° |
| Cell volume | 4246.3 ± 0.3 Å3 |
| Cell temperature | 122.99 ± 0.12 K |
| Ambient diffraction temperature | 122.99 ± 0.12 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 | 0.0925 |
| Residual factor for significantly intense reflections | 0.0763 |
| Weighted residual factors for significantly intense reflections | 0.1806 |
| Weighted residual factors for all reflections included in the refinement | 0.1904 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 280340 (current) | 2023-01-14 | cif/ Adding structures of 7712108, 7712109, 7712110 via cif-deposit CGI script. |
7712110.cif |
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Users of the data should acknowledge the original authors of the
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