Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7055752
Preview
Coordinates | 7055752.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H35 N5 |
---|---|
Calculated formula | C36 H35 N5 |
SMILES | c1ccc(N(c2ccc(cc2)/C=N/c2ccc(N(C)C)cc2)c2ccc(cc2)/C=N/c2ccc(N(C)C)cc2)cc1 |
Title of publication | Branching effect for aggregation-induced emission in fluorophores containing imine and triphenylamine structures |
Authors of publication | Li, Chunchun; Yang, Wen; Zhou, Weiqun; Zhang, Mengmeng; Xue, Renyu; Li, Mengying; Cheng, Zhongqin |
Journal of publication | New J. Chem. |
Year of publication | 2016 |
Journal volume | 40 |
Journal issue | 10 |
Pages of publication | 8837 |
a | 15.6424 ± 0.001 Å |
b | 9.5888 ± 0.0008 Å |
c | 20.3871 ± 0.0011 Å |
α | 90° |
β | 108.266 ± 0.006° |
γ | 90° |
Cell volume | 2903.8 ± 0.4 Å3 |
Cell temperature | 297.56 ± 0.19 K |
Ambient diffraction temperature | 297.56 ± 0.19 K |
Number of distinct elements | 3 |
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 | 0.0829 |
Residual factor for significantly intense reflections | 0.0487 |
Weighted residual factors for significantly intense reflections | 0.1427 |
Weighted residual factors for all reflections included in the refinement | 0.1711 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.982 |
Diffraction radiation probe | x-ray |
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/7055752.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.