Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7127975
Preview
Coordinates | 7127975.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | suitane |
---|---|
Chemical name | suitane |
Formula | C30 H20 B F4 N2 O12 |
Calculated formula | C274.552 H289.884 B4 F16 N8 O44 |
Title of publication | Fluorescence emission enhancement of a T-shaped benzimidazole with a mechanically-interlocked 'suit'. |
Authors of publication | Xu, Houyang; Lin, Meng-Di; Yuan, Jun; Zhou, Baiyang; Mu, Yingxiao; Huo, Yanping; Zhu, Kelong |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2021 |
Journal volume | 57 |
Journal issue | 26 |
Pages of publication | 3239 - 3242 |
a | 15.4345 ± 0.0008 Å |
b | 27.2605 ± 0.0016 Å |
c | 18.41 ± 0.0011 Å |
α | 90° |
β | 115.234 ± 0.002° |
γ | 90° |
Cell volume | 7006.9 ± 0.7 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1087 |
Residual factor for significantly intense reflections | 0.0891 |
Weighted residual factors for significantly intense reflections | 0.2639 |
Weighted residual factors for all reflections included in the refinement | 0.2832 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
Diffraction radiation wavelength | 1.34138 Å |
Diffraction radiation type | GaKα |
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/7127975.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.