Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4131565
Preview
Coordinates | 4131565.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | PF156 |
---|---|
Chemical name | sarpong138 |
Formula | C20 H26 O3 |
Calculated formula | C20 H26 O3 |
Title of publication | Total Synthesis of Terpenoids Employing a "Benzannulation of Carvone" Strategy: Synthesis of (-)-Crotogoudin. |
Authors of publication | Finkbeiner, Peter; Murai, Kenichi; Röpke, Michael; Sarpong, Richmond |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2017 |
Journal volume | 139 |
Journal issue | 33 |
Pages of publication | 11349 - 11352 |
a | 9.2436 ± 0.0004 Å |
b | 10.9618 ± 0.0004 Å |
c | 34.6834 ± 0.0015 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3514.3 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 3 |
Space group number | 20 |
Hermann-Mauguin space group symbol | C 2 2 21 |
Hall space group symbol | C 2c 2 |
Residual factor for all reflections | 0.0704 |
Residual factor for significantly intense reflections | 0.0664 |
Weighted residual factors for significantly intense reflections | 0.1451 |
Weighted residual factors for all reflections included in the refinement | 0.1468 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.127 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4131565.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.