Information card for entry 4066303
| Formula |
C33 H28 B F15 N2 O2 |
| Calculated formula |
C33 H19 B F15 N2 O2 |
| Title of publication |
Frustrated Lewis Pairs and Ring-Opening of THF, Dioxane, and Thioxane† |
| Authors of publication |
Birkmann, Birgit; Voss, Tanja; Geier, Stephen J.; Ullrich, Matthias; Kehr, Gerald; Erker, Gerhard; Stephan, Douglas W. |
| Journal of publication |
Organometallics |
| Year of publication |
2010 |
| Journal volume |
29 |
| Journal issue |
21 |
| Pages of publication |
5310 |
| a |
20.136 ± 0.003 Å |
| b |
18.474 ± 0.003 Å |
| c |
9.9822 ± 0.0015 Å |
| α |
90° |
| β |
112.825 ± 0.004° |
| γ |
90° |
| Cell volume |
3422.5 ± 0.9 Å3 |
| Cell temperature |
150 ± 2 K |
| Ambient diffraction temperature |
150 ± 2 K |
| Number of distinct elements |
6 |
| Space group number |
9 |
| Hermann-Mauguin space group symbol |
C 1 c 1 |
| Hall space group symbol |
C -2yc |
| Residual factor for all reflections |
0.1396 |
| Residual factor for significantly intense reflections |
0.0628 |
| Weighted residual factors for significantly intense reflections |
0.1298 |
| Weighted residual factors for all reflections included in the refinement |
0.1596 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.008 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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