Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7707120
Preview
Coordinates | 7707120.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C680 H1023 Cl10 Co40 N97 O177 S40 |
---|---|
Calculated formula | C521 H652 Cl10 Co40 N44 O124 S40 |
Title of publication | A novel series of giant cobalt-calixarene macrocycles: ring-expansion and modulation of pore apertures through recrystallization. |
Authors of publication | Zhang, Kai; Du, Shao-Wu |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2021 |
Journal volume | 50 |
Journal issue | 18 |
Pages of publication | 6181 - 6187 |
a | 23.7232 ± 0.0003 Å |
b | 31.4851 ± 0.0004 Å |
c | 36.7204 ± 0.0005 Å |
α | 69.633 ± 0.001° |
β | 71.579 ± 0.001° |
γ | 84.696 ± 0.001° |
Cell volume | 24390.5 ± 0.6 Å3 |
Cell temperature | 119.99 ± 0.13 K |
Ambient diffraction temperature | 119.99 ± 0.13 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1295 |
Residual factor for significantly intense reflections | 0.0828 |
Weighted residual factors for significantly intense reflections | 0.2551 |
Weighted residual factors for all reflections included in the refinement | 0.2878 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.3405 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/7707120.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.