Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2205706
Preview
Coordinates | 2205706.cif |
---|---|
Structure factors | 2205706.hkl |
Original IUCr paper | HTML |
Chemical name | bis[μ-salicylaldehyde (1-carboxylatoethylidene)hydrazonato(2-)]bis[ethanolbis(4-fluorobenzyl)tin(IV)] |
---|---|
Formula | C52 H52 F4 N4 O10 Sn2 |
Calculated formula | C52 H52 F4 N4 O10 Sn2 |
SMILES | [Sn]123([OH]CC)(Cc4ccc(F)cc4)(Cc4ccc(F)cc4)[N](N=C(O2)c2c(O)cccc2)=C(C)C(=O)[O]1[Sn]12([OH]CC)(Cc4ccc(F)cc4)(Cc4ccc(F)cc4)[N](N=C(O2)c2c(O)cccc2)=C(C)C(=O)[O]13 |
Title of publication | Bis(4-fluorobenzyl)tin(IV) ester of pyruvic acid salicylhydrazone |
Authors of publication | Min Hong; Handong Yin; Daqi Wang; Zhongjun Gao |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2005 |
Journal volume | 61 |
Journal issue | 5 |
Pages of publication | m801 - m803 |
a | 11.063 ± 0.002 Å |
b | 18.313 ± 0.003 Å |
c | 12.615 ± 0.002 Å |
α | 90° |
β | 92.578 ± 0.002° |
γ | 90° |
Cell volume | 2553.2 ± 0.7 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0475 |
Residual factor for significantly intense reflections | 0.0288 |
Weighted residual factors for significantly intense reflections | 0.0677 |
Weighted residual factors for all reflections included in the refinement | 0.0799 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2205706.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.