Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2001501
Preview
Coordinates | 2001501.cif |
---|---|
Original IUCr paper | HTML |
Formula | C12 H36 K4 O4 Si4 |
---|---|
Calculated formula | C12 H36 K4 O4 Si4 |
SMILES | [K]12[O]3([Si](C)(C)C)[K]4[O]1([Si](C)(C)C)[K]1[O]2([Si](C)(C)C)[K]3[O]14([Si](C)(C)C) |
Title of publication | Structure of potassium silanolate at 153 K |
Authors of publication | Pauer, F.; Sheldrick, G. M. |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1993 |
Journal volume | 49 |
Journal issue | 7 |
Pages of publication | 1283 - 1284 |
a | 17.573 ± 0.002 Å |
b | 17.573 ± 0.002 Å |
c | 17.573 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5426.7 ± 1.1 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 5 |
Space group number | 219 |
Hermann-Mauguin space group symbol | F -4 3 c |
Hall space group symbol | F -4a 2 3 |
Residual factor for all reflections | 0.0364 |
Residual factor for significantly intense reflections | 0.0227 |
Weighted residual factors for all reflections | 0.0716 |
Weighted residual factors for significantly intense reflections | 0.0518 |
Goodness-of-fit parameter for all reflections | 1.084 |
Goodness-of-fit parameter for significantly intense reflections | 1.084 |
Diffraction radiation wavelength | 0.71072 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/2001501.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.