Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2228210
Preview
Coordinates | 2228210.cif |
---|---|
Structure factors | 2228210.hkl |
Original IUCr paper | HTML |
Common name | (<i>R</i>)-[1-(2-Chlorophenyl)-2-methoxy-2-oxoethyl][2-(thiophen-2- yl)ethyl]ammonium (+)-[7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl]methanesulfonate acetone monosolvate |
---|---|
Chemical name | (<i>R</i>)-[1-(2-Chlorophenyl)-2-methoxy-2-oxoethyl][2-(thiophen-2- yl)ethyl]ammonium (+)-camphor-10-sulfonate acetone monosolvate |
Formula | C28 H38 Cl N O7 S2 |
Calculated formula | C28 H38 Cl N O7 S2 |
Title of publication | (<i>R</i>)-[1-(2-Chlorophenyl)-2-methoxy-2-oxoethyl][2-(thiophen-2-yl)ethyl]ammonium (+)-camphor-10-sulfonate acetone monosolvate |
Authors of publication | Liang, Yan-Shu; Mu, Shuai; Liu, Ying; Liu, Deng-Ke |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2010 |
Journal volume | 66 |
Journal issue | 12 |
Pages of publication | o3117 |
a | 12.101 ± 0.003 Å |
b | 14.209 ± 0.004 Å |
c | 18.325 ± 0.005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3150.9 ± 1.5 Å3 |
Cell temperature | 294 ± 2 K |
Ambient diffraction temperature | 294 ± 2 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0852 |
Residual factor for significantly intense reflections | 0.0391 |
Weighted residual factors for significantly intense reflections | 0.0803 |
Weighted residual factors for all reflections included in the refinement | 0.0957 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.994 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2228210.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.