Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7042108
Preview
Coordinates | 7042108.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C25 H22 P2 |
---|---|
Calculated formula | C25 H22 P2 |
SMILES | P(CP(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Slow magnetic relaxation in a Co(ii) octahedral-tetrahedral system formed of a [CoL3](2+) core with L = bis(diphenylphosphanoxido) methane and tetrahedral [CoBr4](2-) counter anions. |
Authors of publication | Varga, F.; Rajnák, C; Titiš, J; Moncoľ, J; Boča, R |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2017 |
Journal volume | 46 |
Journal issue | 13 |
Pages of publication | 4148 - 4151 |
a | 9.7475 ± 0.0003 Å |
b | 10.2186 ± 0.0004 Å |
c | 40.1933 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4003.5 ± 0.2 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 3 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0412 |
Residual factor for significantly intense reflections | 0.0295 |
Weighted residual factors for significantly intense reflections | 0.072 |
Weighted residual factors for all reflections included in the refinement | 0.0741 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.905 |
Diffraction radiation wavelength | 1.54186 Å |
Diffraction radiation type | CuKα |
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/7042108.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.