Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4131152
Preview
Coordinates | 4131152.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H18 Br2 O2 |
---|---|
Calculated formula | C20 H18 Br2 O2 |
SMILES | Brc1ccc(C2(C=CC(C=C2)(c2ccc(Br)cc2)OC)OC)cc1 |
Title of publication | A New Solution to an Old Problem: Synthesis of Unsubstituted Poly(para-phenylene). |
Authors of publication | Abdulkarim, Ali; Hinkel, Felix; Jänsch, Daniel; Freudenberg, Jan; Golling, Florian E.; Müllen, Klaus |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2016 |
Journal volume | 138 |
Journal issue | 50 |
Pages of publication | 16208 - 16211 |
a | 19.57 ± 0.002 Å |
b | 19.57 ± 0.002 Å |
c | 9.704 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3716.5 ± 0.9 Å3 |
Cell temperature | 173 K |
Number of distinct elements | 4 |
Space group number | 114 |
Hermann-Mauguin space group symbol | P -4 21 c |
Hall space group symbol | P -4 2n |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
241432 (current) | 2019-11-25 | cif/ Adding structures of 4131152 via cif-deposit CGI script. |
4131152.cif |
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.