Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4109207
Preview
Coordinates | 4109207.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C24 H12 O13 Zn4 |
---|---|
Calculated formula | C24 H12 O13 Zn4 |
Title of publication | The Inconsistency in Adsorption Properties and Powder XRD Data of MOF-5 Is Rationalized by Framework Interpenetration and the Presence of Organic and Inorganic Species in the Nanocavities |
Authors of publication | Jasmina Hafizovic; Morten Bjørgen; Unni Olsbye; Pascal D. C. Dietzel; Silvia Bordiga; Carmelo Prestipino; Carlo Lamberti; Karl Petter Lillerud |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2007 |
Journal volume | 129 |
Pages of publication | 3612 - 3620 |
a | 18.452 ± 0.006 Å |
b | 18.452 ± 0.006 Å |
c | 44.933 ± 0.006 Å |
α | 90 ± 0.011° |
β | 90 ± 0.011° |
γ | 120 ± 0.011° |
Cell volume | 13249 ± 7 Å3 |
Cell temperature | 573 ± 2 K |
Ambient diffraction temperature | 573 ± 2 K |
Number of distinct elements | 4 |
Space group number | 166 |
Hermann-Mauguin space group symbol | R -3 m :H |
Hall space group symbol | -R 3 2" |
Residual factor for all reflections | 0.0685 |
Residual factor for significantly intense reflections | 0.0374 |
Weighted residual factors for significantly intense reflections | 0.0898 |
Weighted residual factors for all reflections included in the refinement | 0.1201 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.163 |
Diffraction radiation wavelength | 0.38745 Å |
Diffraction radiation type | Synchrotron |
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/4109207.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.