Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7220842
Preview
Coordinates | 7220842.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (Z)-((4-(N,N-dimethyl)phenyl)(2-ethoxycarbonylvinyl)telluride |
---|---|
Chemical name | (Z)-Ethyl 2-(4'-(N,N-dimethyl)phenyltelluro)acrylate |
Formula | C13 H17 N O2 Te |
Calculated formula | C13 H17 N O2 Te |
SMILES | [Te](c1ccc(N(C)C)cc1)/C=C\C(=O)OCC |
Title of publication | Hydrotelluration of acetylenic Esters: Structural Characterization of Stereoisomers of Methyl/ethyl (β-aryltelluro)acrylates |
Authors of publication | Chauhan, Ashok Kumar Singh; Singh, Bandana; Srivastava, Ramesh Chandra; Duthie, Andrew; Butcher, Ray Jay |
Journal of publication | RSC Adv. |
Year of publication | 2015 |
a | 8.6633 ± 0.0003 Å |
b | 11.3506 ± 0.0003 Å |
c | 14.3428 ± 0.0005 Å |
α | 90° |
β | 103.46 ± 0.003° |
γ | 90° |
Cell volume | 1371.64 ± 0.08 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0451 |
Residual factor for significantly intense reflections | 0.031 |
Weighted residual factors for significantly intense reflections | 0.0643 |
Weighted residual factors for all reflections included in the refinement | 0.0718 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.071 |
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/7220842.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.