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CIF Information Card
Information card for 4114578
4114577 << 4114578 >> 4114579Preview
|
Coordinates |
4114578.cif |
Structure parameters
| Formula | - C48 H84 N4 Nb2 P4 Si8 - |
| Calculated formula | - C48 H78 N4 Nb2 P4 Si8 - |
| Title of publication | Phosphorus Phenyl-Group Activation by Reduced Zirconium and Niobium Complexes Stabilized by the [P2N2] Macrocycle |
| Authors of publication | Michael D. Fryzuk; Christopher M. Kozak; Parisa Mehrkhodavandi; Lara Morello; Brian O. Patrick; Steven J. Rettig |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2002 |
| Journal volume | 124 |
| Pages of publication | 516 - 517 |
| a | 10.186 ± 0.0006 Å |
| b | 11.2073 ± 0.0006 Å |
| c | 13.2219 ± 0.0007 Å |
| α | 86.865 ± 0.002° |
| β | 88.448 ± 0.003° |
| γ | 86.208 ± 0.004° |
| Cell volume | 1503.4 ± 0.14 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0434 |
| Residual factor for observed reflections | 0.0347 |
| Weighted residual factors for the observed reflections | 0.0862 |
| Weighted residual factors for all reflections included in the refinement | 0.0932 |
| Goodness-of-fit parameter for observed reflections | 1.054 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |