Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7242028
Preview
Coordinates | 7242028.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C50 H26 N8 O21 |
---|---|
Calculated formula | C50 H26 N8 O21 |
Title of publication | Functionalized naphthalenediimide based supramolecular charge-transfer complexes via self-assembly and their photophysical properties |
Authors of publication | Rani, Pooja; Husain, Ahmad; Shukla, Ananya; Singla, Neha; Srivastava, Ankit Kumar; Kumar, Gulshan; Bhasin, K. K.; Kumar, Girijesh |
Journal of publication | CrystEngComm |
Year of publication | 2021 |
Journal volume | 23 |
Journal issue | 8 |
Pages of publication | 1859 - 1869 |
a | 7.7993 ± 0.0003 Å |
b | 22.8606 ± 0.0008 Å |
c | 33.5658 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5984.7 ± 0.4 Å3 |
Cell temperature | 138 K |
Ambient diffraction temperature | 138 K |
Number of distinct elements | 4 |
Space group number | 66 |
Hermann-Mauguin space group symbol | C c c m |
Hall space group symbol | -C 2 2c |
Residual factor for all reflections | 0.1621 |
Residual factor for significantly intense reflections | 0.1258 |
Weighted residual factors for significantly intense reflections | 0.3764 |
Weighted residual factors for all reflections included in the refinement | 0.3999 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.493 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7242028.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.