Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4320177
Preview
Coordinates | 4320177.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C24 H54 N6 O17 S3 |
---|---|
Calculated formula | C24 H54 N6 O17 S3 |
Title of publication | Anion Binding with Two Polyammonium Macrocycles of Different Dimensionality |
Authors of publication | Thomas Clifford; Andrew Danby; José M. Llinares; Susan Mason; Nathaniel W. Alcock; Douglas Powell; Juan A. Aguilar; Enrique García-España; Kristin Bowman-James |
Journal of publication | Inorganic Chemistry |
Year of publication | 2001 |
Journal volume | 40 |
Pages of publication | 4710 - 4720 |
a | 10.7345 ± 0.0003 Å |
b | 29.6422 ± 0.0004 Å |
c | 5.7286 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1822.81 ± 0.09 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 5 |
Space group number | 38 |
Hermann-Mauguin space group symbol | A m m 2 |
Hall space group symbol | A 2 -2 |
Residual factor for all reflections | 0.0769 |
Residual factor for significantly intense reflections | 0.0587 |
Weighted residual factors for significantly intense reflections | 0.1414 |
Weighted residual factors for all reflections included in the refinement | 0.1527 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.128 |
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/4320177.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.