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CIF Information Card
Information card for 7101653
7101652 << 7101653 >> 7101654Preview
|
Coordinates |
7101653.cif |
Structure parameters
| Formula | - C34 H31 O6 P Ru - |
| Calculated formula | - C34 H31 O6 P Ru - |
| Title of publication | Ruthenium-catalysed linear-selective allylic alkylation of allyl acetates. |
| Authors of publication | Kawatsura, Motoi; Ata, Fumio; Wada, Shohei; Hayase, Shuichi; Uno, Hidemitsu; Itoh, Toshiyuki |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2007 |
| Journal issue | 3 |
| Pages of publication | 298 - 300 |
| a | 12.846 ± 0.002 Å |
| b | 16.061 ± 0.003 Å |
| c | 14.566 ± 0.004 Å |
| α | 90° |
| β | 90.612 ± 0.011° |
| γ | 90° |
| Cell volume | 3005.1 ± 1.1 Å3 |
| Cell temperature | 173.1 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Residual factor for all reflections | 0.1064 |
| Residual factor for observed reflections | 0.0747 |
| Weighted residual factors for the observed reflections | 0.1545 |
| Weighted residual factors for all reflections included in the refinement | 0.1735 |
| Goodness-of-fit parameter for observed reflections | 1.046 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |