Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1564081
Preview
Coordinates | 1564081.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | bismuth(III) 2,6-dipicolylbis(N,N-diethylthiourea) |
---|---|
Formula | C102 H145 Bi6 N36 O34 S12 |
Calculated formula | C102 H138 Bi6 N36 O34 S12 |
Title of publication | Synthesis, characterization and biological applications of bismuth(III) complexes with aroylthiourea ligands |
Authors of publication | de Oliveira, Marcielli Indiara; Chuy, Gabriela Pereira; Vizzotto, Bruno Stefanello; Burrow, Robert Alan; Lang, Ernesto Schulz; dos Santos, Sailer Santos |
Journal of publication | Inorganica Chimica Acta |
Year of publication | 2020 |
Journal volume | 512 |
Pages of publication | 119871 |
a | 17.253 ± 0.002 Å |
b | 22.953 ± 0.003 Å |
c | 19.622 ± 0.003 Å |
α | 90° |
β | 100.207 ± 0.004° |
γ | 90° |
Cell volume | 7647.5 ± 1.8 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 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 | 0.1094 |
Residual factor for significantly intense reflections | 0.0459 |
Weighted residual factors for significantly intense reflections | 0.0926 |
Weighted residual factors for all reflections included in the refinement | 0.1152 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 0.56086 Å |
Diffraction radiation type | AgKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1564081.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.