Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1517941
Preview
Coordinates | 1517941.cif |
---|
Formula | C64 H136 Cd4 N8 Na4 O28 Te12 |
---|---|
Calculated formula | C64 Cd4 N8 Na4 O28 Te12 |
SMILES | C1C[O]2[Na]345[O](CC2)CC[O]5CC[O]4CC[O]13.N(C=O)(C)C.N(C=O)(C)C.N(C=O)(C)C.[O]12CC[O]3CC[O]4[Na]523[O](CC[O]5CC4)CC1.[Cd]123[Te][Cd]45[Te]6[Cd]7([Te][Cd]([Te]1[Te]47)([Te]26)[Te][Te][Te]3)[Te][Te][Te]5.O=CN(C)C.C1C[O]2CC[O]3CC[O]4CC[O]5CC[O]1[Na]2345.N(C=O)(C)C.N(C=O)(C)C.N(C=O)(C)C.N(C=O)(C)C.[O]12CC[O]3CC[O]4CC[O]5CC[O](CC1)[Na]2345 |
Title of publication | Synthesis and crystal structure of [Na(15-Crown-5]4[Cd4Te12].8DMF |
Authors of publication | Schreiner, Bernhard; Dehnicke, Kurt; Fenske, Dieter |
Journal of publication | Zeitschrift fuer Anorganische und Allgemeine Chemie |
Year of publication | 1993 |
Journal volume | 619 |
Pages of publication | 1127 - 1131 |
a | 16.229 ± 0.006 Å |
b | 20.382 ± 0.005 Å |
c | 17.398 ± 0.002 Å |
α | 90° |
β | 92.26 ± 0.02° |
γ | 90° |
Cell volume | 5750 ± 3 Å3 |
Ambient diffraction temperature | 223 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for significantly intense reflections | 0.0383 |
Weighted residual factors for significantly intense reflections | 0.0328 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71069 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/1517941.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.