Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7159203
Preview
Coordinates | 7159203.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (tert-butyl (E)-(5-hydroxy-2-methylpent-3-en-2-yl)carbamate) |
---|---|
Chemical name | (tert-butyl (E)-(5-hydroxy-2-methylpent-3-en-2-yl)carbamate) |
Formula | C11 H21 N O3 |
Calculated formula | C11 H21 N O3 |
Title of publication | Stereoselective synthesis of backbone extended π-conjugated amino esters. |
Authors of publication | Nalawade, Sachin A.; Singh, Manjeet; Puneeth Kumar, DRGKoppalu R; Dey, Sanjit; Gopi, Hosahudya N. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2023 |
Journal volume | 21 |
Journal issue | 12 |
Pages of publication | 2586 - 2595 |
a | 9.165 ± 0.002 Å |
b | 10.586 ± 0.003 Å |
c | 13.936 ± 0.003 Å |
α | 90.989 ± 0.008° |
β | 108.378 ± 0.007° |
γ | 91.637 ± 0.008° |
Cell volume | 1282.1 ± 0.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1417 |
Residual factor for significantly intense reflections | 0.0941 |
Weighted residual factors for significantly intense reflections | 0.1383 |
Weighted residual factors for all reflections included in the refinement | 0.1561 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.152 |
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/7159203.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.