Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4301606
Preview
Coordinates | 4301606.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | catena-[{μ4-1,2-Bis(1,2,4-triazol-4-yl)ethane-κN1:κN2:κN1':κN2'}- {μ2-bis(1,2,4-triazol-4-yl)ethane-κN1:κN2}zinc(II)] diperchlorate |
---|---|
Formula | C12 H16 Cl2 N12 O8 Zn |
Calculated formula | C12 H16 Cl2 N12 O8 Zn |
Title of publication | Crystal Structure Solid-State Cross Polarization Magic Angle Spinning 13C NMR Correlation in Luminescent d10 Metal-Organic Frameworks Constructed with the 1,2-Bis(1,2,4-triazol-4-yl)ethane Ligand |
Authors of publication | Hesham A. Habib; Anke Hoffmann; Henning A. Höppe; Gunther Steinfeld; Christoph Janiak |
Journal of publication | Inorganic Chemistry |
Year of publication | 2009 |
Journal volume | 48 |
Pages of publication | 2166 - 2180 |
a | 8.0135 ± 0.0003 Å |
b | 17.658 ± 0.0007 Å |
c | 13.8841 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1964.63 ± 0.14 Å3 |
Cell temperature | 203 ± 2 K |
Ambient diffraction temperature | 203 ± 2 K |
Number of distinct elements | 6 |
Space group number | 62 |
Hermann-Mauguin space group symbol | P n m a |
Hall space group symbol | -P 2ac 2n |
Residual factor for all reflections | 0.0639 |
Residual factor for significantly intense reflections | 0.0483 |
Weighted residual factors for significantly intense reflections | 0.1277 |
Weighted residual factors for all reflections included in the refinement | 0.1369 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.108 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/4301606.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.