Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4128903
Preview
| Coordinates | 4128903.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C33 H40 B F4 Fe O4 P |
|---|---|
| Calculated formula | C33 H40 B F4 Fe O4 P |
| Title of publication | Organoiron- and Fluoride-Catalyzed Phosphinidene Transfer to Styrenic Olefins in a Stereoselective Synthesis of Unprotected Phosphiranes. |
| Authors of publication | Geeson, Michael B.; Transue, Wesley J.; Cummins, Christopher C. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2019 |
| Journal volume | 141 |
| Journal issue | 34 |
| Pages of publication | 13336 - 13340 |
| a | 9.9636 ± 0.001 Å |
| b | 12.7003 ± 0.0013 Å |
| c | 13.9821 ± 0.0015 Å |
| α | 80.831 ± 0.004° |
| β | 69.746 ± 0.004° |
| γ | 70.594 ± 0.003° |
| Cell volume | 1563.6 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.176 |
| Residual factor for significantly intense reflections | 0.1411 |
| Weighted residual factors for significantly intense reflections | 0.3506 |
| Weighted residual factors for all reflections included in the refinement | 0.3753 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 221939 (current) | 2019-11-03 | cif/ Adding structures of 4128903 via cif-deposit CGI script. |
4128903.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.