Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2225081
Preview
Coordinates | 2225081.cif |
---|---|
Structure factors | 2225081.hkl |
Original IUCr paper | HTML |
Chemical name | Triethylammonium bis(2-oxido-2,2-diphenylacetato-κ^2^<i>O</i>^1^,<i>O</i>^2^)antimonate(III) |
---|---|
Formula | C34 H36 N O6 Sb |
Calculated formula | C34 H36 N O6 Sb |
SMILES | [Sb]12(OC(=O)C(O1)(c1ccccc1)c1ccccc1)OC(=O)C(O2)(c1ccccc1)c1ccccc1.[NH+](CC)(CC)CC |
Title of publication | Triethylammonium bis(2-oxido-2,2-diphenylacetato-κ^2^<i>O</i>^1^,<i>O</i>^2^)antimonate(III) |
Authors of publication | Reza, Md. Yeamin; Hossain, Md. Motahar; Karim, Md. Rabiul; Tarafder, Md. Tofazzal Hossain; Hughes, David L. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2010 |
Journal volume | 66 |
Journal issue | 2 |
Pages of publication | m116 - m117 |
a | 12.34379 ± 0.00013 Å |
b | 10.63317 ± 0.00012 Å |
c | 22.5264 ± 0.0003 Å |
α | 90° |
β | 90.6466 ± 0.0011° |
γ | 90° |
Cell volume | 2956.48 ± 0.06 Å3 |
Cell temperature | 140 ± 1 K |
Ambient diffraction temperature | 140 ± 1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0378 |
Residual factor for significantly intense reflections | 0.0226 |
Weighted residual factors for significantly intense reflections | 0.0465 |
Weighted residual factors for all reflections included in the refinement | 0.0494 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.008 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | Mo-Kα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2225081.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.