Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1570220
Preview
Coordinates | 1570220.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H18 |
---|---|
Calculated formula | C27 H18 |
Title of publication | Stepwise deprotonation of truxene: structures, metal complexation, and charge-dependent optical properties. |
Authors of publication | Guo, Yumeng; Torchon, Herdya S.; Zhu, Yikun; Wei, Zheng; Zhang, Zhenyi; Han, Haixiang; Petrukhina, Marina A.; Zhou, Zheng |
Journal of publication | Chemical science |
Year of publication | 2023 |
Journal volume | 14 |
Journal issue | 45 |
Pages of publication | 13219 - 13227 |
a | 4.6856 ± 0.0001 Å |
b | 16.2628 ± 0.0005 Å |
c | 11.3085 ± 0.0004 Å |
α | 90° |
β | 90.473 ± 0.002° |
γ | 90° |
Cell volume | 861.69 ± 0.04 Å3 |
Cell temperature | 157 ± 2 K |
Ambient diffraction temperature | 157 ± 2 K |
Number of distinct elements | 2 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0439 |
Residual factor for significantly intense reflections | 0.0405 |
Weighted residual factors for significantly intense reflections | 0.105 |
Weighted residual factors for all reflections included in the refinement | 0.1076 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 1.54178 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/1570220.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.