Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7058697
Preview
Coordinates | 7058697.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H21 Br2 Cl Fe N3 O3 |
---|---|
Calculated formula | C19 H21 Br2 Cl Fe N3 O3 |
Title of publication | Impact of the Schiff base ligand substituents on the solid state and solution properties of eleven iron(iii) complexes |
Authors of publication | Pogány, Lukáš; Brachňaková, Barbora; Masárová, Petra; Moncol, Ján; Pavlik, Ján; Gál, Miroslav; Mazúr, Milan; Herchel, Radovan; Nemec, Ivan; Šalitroš, Ivan |
Journal of publication | New Journal of Chemistry |
Year of publication | 2019 |
Journal volume | 43 |
Journal issue | 35 |
Pages of publication | 13916 |
a | 11.536 ± 0.0004 Å |
b | 12.673 ± 0.0004 Å |
c | 16.2456 ± 0.0005 Å |
α | 94.651 ± 0.002° |
β | 101.474 ± 0.003° |
γ | 106.584 ± 0.003° |
Cell volume | 2206.59 ± 0.13 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0474 |
Residual factor for significantly intense reflections | 0.029 |
Weighted residual factors for significantly intense reflections | 0.0575 |
Weighted residual factors for all reflections included in the refinement | 0.0596 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.94 |
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/7058697.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.