Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1559078
Preview
Coordinates | 1559078.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | [CoL(NCCH3)2Cl]CoCl4 (L = 1,4,7-Trimethyl-1,4,7-triazacyclononane) |
---|---|
Formula | C13 H27 Cl5 Co2 N5 |
Calculated formula | C11.5 Cl6.5 Co2 N5 |
Title of publication | The Structure of a Novel Complex of Cobalt(III) with a Tridentate Macrocyclic Ligand with Tertiary Amine Donors, [CoL(NCCH3)2Cl]CoCl4 (L = 1,4,7-Trimethyl-1,4,7-triazacyclononane) |
Authors of publication | Searle, Graeme H.; Wang, Dong-Ni; Larsen, Sine; Larsen, Erik |
Journal of publication | Acta Chemica Scandinavica |
Year of publication | 1992 |
Journal volume | 46 |
Pages of publication | 38 - 42 |
a | 12.172 ± 0.003 Å |
b | 14.331 ± 0.004 Å |
c | 26.032 ± 0.005 Å |
α | 90° |
β | 98.37 ± 0.02° |
γ | 90° |
Cell volume | 4492.6 ± 1.9 Å3 |
Ambient diffraction temperature | 110 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for significantly intense reflections | 0.058 |
Weighted residual factors for significantly intense reflections | 0.062 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.1 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
256403 (current) | 2020-09-14 | cif/ Adding structures of 1559078 via cif-deposit CGI script. |
1559078.cif |
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.