Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2010619
Preview
Coordinates | 2010619.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | [2-acetylpyridine-(4-phenylthiosemicarbazonoato)- N,N,S)]-bromo-transdimethyl-tin(IV), |
---|---|
Formula | C16 H19 Br N4 S Sn |
Calculated formula | C16 H19 Br N4 S Sn |
SMILES | [Sn]12(C)(C)(Br)[N](=C(c3[n]2cccc3)C)N=C(S1)Nc1ccccc1 |
Title of publication | (2-Acetylpyridine-κ<i>N</i> 4-phenylthiosemicarbazonato-κ^2^<i>N</i>^1^,<i>S</i>)halogeno-<i>trans</i>-dimethyltin(IV) (halogeno = chloro and bromo) |
Authors of publication | Francisco, Regina H. P.; Gambardella, M. Teresa do P.; Sousa, Gerimário F. de; Abras, Anuar |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2000 |
Journal volume | 56 |
Journal issue | 2 |
Pages of publication | 187 - 189 |
a | 10.1858 ± 0.0009 Å |
b | 15.3819 ± 0.0018 Å |
c | 12.0726 ± 0.0007 Å |
α | 90° |
β | 97.56 ± 0.006° |
γ | 90° |
Cell volume | 1875.1 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.12 |
Residual factor for significantly intense reflections | 0.04 |
Weighted residual factors for all reflections included in the refinement | 0.106 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
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/2010619.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.