Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4119779
Preview
| Coordinates | 4119779.cif |
|---|---|
| Structure factors | 4119779.hkl |
| Original paper (by DOI) | HTML |
| Formula | C2 N2 Zn |
|---|---|
| Calculated formula | C2.33333 N2.33333 Zn |
| Title of publication | Exploiting High Pressures to Generate Porosity, Polymorphism, And Lattice Expansion in the Nonporous Molecular Framework Zn(CN)2 |
| Authors of publication | Saul H. Lapidus; Gregory J. Halder; Peter J. Chupas; Karena W. Chapman |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2013 |
| Journal volume | 135 |
| Pages of publication | 7621 - 7628 |
| a | 12.48147 ± 0.00027 Å |
| b | 12.48147 Å |
| c | 12.48147 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1944.45 ± 0.04 Å3 |
| Cell temperature | 295 K |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 3 |
| Space group number | 205 |
| Hermann-Mauguin space group symbol | P a -3 |
| Hall space group symbol | -P 2ac 2ab 3 |
| Goodness-of-fit parameter for all reflections | 0.424 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 0.615183 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181929 (current) | 2016-04-07 | hkl/4/ (antanas@echidna.ibt.lt) Adding svn headers to multiple entries in subrange 4/11. |
4119779.cif 4119779.hkl |
| 180700 | 2016-04-02 | cod/ (antanas@echidna.ibt.lt) Setting the 'svn:keywords' property for all '*.hkl' files that were previously unaffected by this property. |
4119779.cif 4119779.hkl |
| 178968 | 2016-03-22 | cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/97. |
4119779.cif 4119779.hkl |
| 107629 | 2014-03-20 | hkl/4 Insert experimental data from SHELX-13 generated files for JACS-2013 entries. |
4119779.cif 4119779.hkl |
| 103961 | 2014-03-10 | cif/ Adding structures of 4119779 via cif-deposit CGI script. |
4119779.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.