Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 2200234
2200233 << 2200234 >> 2200235Preview
|
Coordinates |
2200234.cif |
|
Structure factors |
2200234.hkl |
Structure parameters
| Common name | Pentafluorobenzonitrile |
| Formula | - C7 F5 N - |
| Calculated formula | - C7 F5 N - |
| Title of publication | Pentafluorobenzonitrile |
| Authors of publication | Bond, Andrew D.; Davies, John E.; Griffiths, Joanne; Rawson, Jeremy M. |
| Journal of publication | Acta Crystallographica, Section E |
| Year of publication | 2001 |
| Journal volume | 57 |
| Pages of publication | o231 - o233 |
| a | 7.6864 ± 0.0005 Å |
| b | 9.5175 ± 0.0003 Å |
| c | 18.348 ± 0.0012 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1342.25 ± 0.13 Å3 |
| Cell temperature | 180 ± 2 K |
| Ambient diffraction temperature | 180 ± 2 K |
| Number of distinct elements | 3 |
| Hermann-Mauguin symmetry space group | C m c a |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |