Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4116453
Preview
Coordinates | 4116453.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Tetrakis(2,6-diphenyliminopiperidinato)dichromium(II) |
---|---|
Formula | C69 H66 Cl2 Cr2 N12 |
Calculated formula | C69.017 H64 Cl2.034 Cr2 N12 |
Title of publication | Remarkable Effects of Axial π* Coordination on the Cr-Cr Quadruple Bond in Dichromium Paddlewheel Complexes |
Authors of publication | F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Isabel Pascual; Hong-Cai Zhou |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 1999 |
Journal volume | 121 |
Pages of publication | 6856 - 6861 |
a | 27.197 ± 0.003 Å |
b | 16.467 ± 0.008 Å |
c | 29.511 ± 0.01 Å |
α | 90° |
β | 110.43 ± 0.02° |
γ | 90° |
Cell volume | 12385 ± 8 Å3 |
Cell temperature | 213 ± 2 K |
Ambient diffraction temperature | 213 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | I 1 2/a 1 |
Hall space group symbol | -I 2ya |
Residual factor for all reflections | 0.091 |
Residual factor for significantly intense reflections | 0.0704 |
Weighted residual factors for all reflections | 0.189 |
Weighted residual factors for significantly intense reflections | 0.1596 |
Goodness-of-fit parameter for all reflections | 1.084 |
Goodness-of-fit parameter for significantly intense reflections | 1.095 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/4116453.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.