Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4329017
Preview
Coordinates | 4329017.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | tetrakis(choline) (mu4-oxo)-hexakis(mu2-chloro)-tetrakis(chloro-copper(ii)) |
---|---|
Chemical name | tetrakis(choline) (mu4-oxo)-hexakis(mu2-chloro)-tetrakis(chloro-copper(ii)) |
Formula | C20 H56 Cl10 Cu4 N4 O5 |
Calculated formula | C20 H54 Cl10 Cu4 N4 O5 |
Title of publication | Speciation of Copper(II) Complexes in an Ionic Liquid Based on Choline Chloride and in Choline Chloride/Water Mixtures |
Authors of publication | Peter De Vreese; Neil R. Brooks; Kristof Van Hecke; Luc Van Meervelt; Edward Matthijs; Koen Binnemans; Rik Van Deun |
Journal of publication | Inorganic Chemistry |
Year of publication | 2012 |
Journal volume | 51 |
Pages of publication | 4972 - 4981 |
a | 22.4693 ± 0.0012 Å |
b | 10.2874 ± 0.0006 Å |
c | 18.5663 ± 0.0011 Å |
α | 90° |
β | 113.551 ± 0.003° |
γ | 90° |
Cell volume | 3934.1 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0805 |
Residual factor for significantly intense reflections | 0.0658 |
Weighted residual factors for significantly intense reflections | 0.1716 |
Weighted residual factors for all reflections included in the refinement | 0.1821 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/4329017.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.