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CIF Information Card
Information card for 4114557
4114556 << 4114557 >> 4114558Preview
|
Coordinates |
4114557.cif |
Structure parameters
| Formula | - C28 H47 B3 O4 Ru2 - |
| Calculated formula | - C28 H47 B3 O4 Ru2 - |
| Title of publication | Ruthenacarboranes from the Reaction of nido-1,2-(Cp*RuH)2B3H7with HC\τbCCO2Me, Cp* = η5-C5Me5. Hydrometalation, Alkyne Incorporation, and Functional Group Modification via Cooperative Metal-Boron Interactions within a Metallaborane Cluster Framework |
| Authors of publication | Hong Yan; Alicia M. Beatty; Thomas P. Fehlner |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2003 |
| Journal volume | 125 |
| Pages of publication | 16367 - 16382 |
| a | 8.576 ± 0.0004 Å |
| b | 10.5548 ± 0.0005 Å |
| c | 18.5784 ± 0.0009 Å |
| α | 73.699 ± 0.001° |
| β | 83.985 ± 0.001° |
| γ | 66.936 ± 0.001° |
| Cell volume | 1485.03 ± 0.12 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0518 |
| Residual factor for observed reflections | 0.0441 |
| Weighted residual factors for the observed reflections | 0.0959 |
| Weighted residual factors for all reflections included in the refinement | 0.0999 |
| Goodness-of-fit parameter for observed reflections | 1.068 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |