Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7154785
Preview
Coordinates | 7154785.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | tert-butyl (3-fluorobicyclo[1.1.1]pentan-1-yl)carbamate |
---|---|
Formula | C10 H16 F N O2 |
Calculated formula | C10 H16 F N O2 |
Title of publication | Radical fluorination powered expedient synthesis of 3-fluorobicyclo[1.1.1]pentan-1-amine. |
Authors of publication | Goh, Yi Ling; Adsool, Vikrant A. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2015 |
Journal volume | 13 |
Journal issue | 48 |
Pages of publication | 11597 - 11601 |
a | 18.9983 ± 0.0006 Å |
b | 11.2142 ± 0.0003 Å |
c | 20.2881 ± 0.0007 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4322.4 ± 0.2 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0755 |
Residual factor for significantly intense reflections | 0.0456 |
Weighted residual factors for significantly intense reflections | 0.1013 |
Weighted residual factors for all reflections included in the refinement | 0.1183 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7154785.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.