Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7234671
Preview
Coordinates | 7234671.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | (E)-3-(5-(diphenylamino)thiophen-2-yl)-1-(pyridin-2-yl)prop-2-en-1-one |
---|---|
Formula | C24 H18 N2 O S |
Calculated formula | C24 H18 N2 O S |
Title of publication | Small molecules of chalcone derivatives with high two-photon absorption activities in the near-IR region |
Authors of publication | Jingyun Tan; Yujin Zhang; Meirong Zhang; Xiaohe Tian; Yiming Wang; Shengli Li; Chuankui Wang; Hongping Zhou; Jiaxiang Yang; Yupeng Tian; Jieying Wu |
Journal of publication | Journal of Materials Chemistry C |
Year of publication | 2016 |
Journal volume | 4 |
Pages of publication | 3256 - 3267 |
a | 10.931 ± 0.005 Å |
b | 18.464 ± 0.005 Å |
c | 9.657 ± 0.005 Å |
α | 90 ± 0.005° |
β | 90 ± 0.005° |
γ | 90 ± 0.005° |
Cell volume | 1949.1 ± 1.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 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 | 0.1628 |
Residual factor for significantly intense reflections | 0.0724 |
Weighted residual factors for significantly intense reflections | 0.1775 |
Weighted residual factors for all reflections included in the refinement | 0.2062 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.97 |
Diffraction radiation wavelength | 0.71069 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/7234671.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.