Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7039580
Preview
Coordinates | 7039580.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H30 N4 O2 |
---|---|
Calculated formula | C22 H30 N4 O2 |
SMILES | N(=O)N(Cc1c(cc(C)cc1C)C)CCN(N=O)Cc1c(cc(C)cc1C)C |
Title of publication | Effect of ligand denticity on the nitric oxide reactivity of cobalt(ii) complexes. |
Authors of publication | Deka, Hemanta; Ghosh, Somnath; Saha, Soumen; Gogoi, Kuldeep; Mondal, Biplab |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 27 |
Pages of publication | 10979 - 10988 |
a | 4.948 ± 0.0004 Å |
b | 17.236 ± 0.002 Å |
c | 12.6051 ± 0.0008 Å |
α | 90° |
β | 91.761 ± 0.007° |
γ | 90° |
Cell volume | 1074.5 ± 0.17 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.137 |
Residual factor for significantly intense reflections | 0.0774 |
Weighted residual factors for significantly intense reflections | 0.1764 |
Weighted residual factors for all reflections included in the refinement | 0.2035 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.23 |
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/7039580.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.