Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4003483
Preview
Coordinates | 4003483.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H12 F2 O4 S4 |
---|---|
Calculated formula | C20 H12 F2 O4 S4 |
Title of publication | Influence of Covalent and Noncovalent Backbone Rigidification Strategies on the Aggregation Structures of a Wide-Band-Gap Polymer for Photovoltaic Cells |
Authors of publication | Li, Sunsun; Zhao, Wenchao; Zhang, Jianqi; Liu, Xiaoyu; Zheng, Zhong; He, Chang; Xu, Bowei; Wei, Zhixiang; Hou, Jianhui |
Journal of publication | Chemistry of Materials |
Year of publication | 2020 |
a | 18.9984 ± 0.0003 Å |
b | 3.80922 ± 0.00006 Å |
c | 26.9065 ± 0.0004 Å |
α | 90° |
β | 97.5378 ± 0.0016° |
γ | 90° |
Cell volume | 1930.37 ± 0.05 Å3 |
Cell temperature | 170 ± 0.13 K |
Ambient diffraction temperature | 170 ± 0.13 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0348 |
Residual factor for significantly intense reflections | 0.0339 |
Weighted residual factors for significantly intense reflections | 0.0968 |
Weighted residual factors for all reflections included in the refinement | 0.0976 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.087 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/4003483.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.