Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7159950
Preview
Coordinates | 7159950.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H30 F N O4 S |
---|---|
Calculated formula | C27 H30 F N O4 S |
Title of publication | Palladium catalyzed stereoselective intramolecular [3 + 2] cycloaddition reactions of (<i>E</i>) & (<i>Z</i>)-ene-vinylidenecyclopropanes. |
Authors of publication | Ning, Chao; Yu, Zi-Qi; Wei, Yin; Shi, Min |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2024 |
Journal volume | 22 |
Journal issue | 22 |
Pages of publication | 4445 - 4449 |
a | 8.8399 ± 0.0003 Å |
b | 10.9638 ± 0.0005 Å |
c | 14.662 ± 0.0006 Å |
α | 71.065 ± 0.001° |
β | 82.388 ± 0.001° |
γ | 67.804 ± 0.001° |
Cell volume | 1244.45 ± 0.09 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0575 |
Residual factor for significantly intense reflections | 0.0438 |
Weighted residual factors for significantly intense reflections | 0.101 |
Weighted residual factors for all reflections included in the refinement | 0.1097 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7159950.html
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.