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Information card for entry 4085574
Preview
| Coordinates | 4085574.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C84 H174 B4 K2 O7 P4 Si8 Sr3 |
|---|---|
| Calculated formula | C84 H174 B4 K2 O7 P4 Si8 Sr3 |
| Title of publication | Structural Diversity in Alkaline Earth Metal Complexes of a Phosphine-Borane-Stabilized 1,3-Dicarbanion |
| Authors of publication | Izod, Keith; Wills, Corinne; El-Hamruni, Salima; Harrington, Ross W.; Waddell, Paul G.; Probert, Michael R. |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 11 |
| Pages of publication | 2406 |
| a | 13.3139 ± 0.0004 Å |
| b | 13.8721 ± 0.0004 Å |
| c | 17.1954 ± 0.0006 Å |
| α | 69.048 ± 0.003° |
| β | 79.922 ± 0.003° |
| γ | 77.4 ± 0.003° |
| Cell volume | 2878 ± 0.17 Å3 |
| Cell temperature | 149.99 ± 0.1 K |
| Ambient diffraction temperature | 149.99 ± 0.1 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0717 |
| Residual factor for significantly intense reflections | 0.0416 |
| Weighted residual factors for significantly intense reflections | 0.0859 |
| Weighted residual factors for all reflections included in the refinement | 0.0989 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178744 (current) | 2016-03-21 | cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/55. |
4085574.cif |
| 140246 | 2015-07-05 | cif/ Updating files of 4085571, 4085572, 4085573, 4085574 Original log message: Adding full bibliography for 4085571--4085574.cif. |
4085574.cif |
| 132562 | 2015-02-28 | cif/ Adding structures of 4085571, 4085572, 4085573, 4085574 via cif-deposit CGI script. |
4085574.cif |
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Users of the data should acknowledge the original authors of the
structural data.