Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 2013160
2013159 << 2013160 >> 2013161Preview
|
Coordinates |
2013160.cif |
|
Structure factors |
2013160.hkl |
Structure parameters
| Formula | - C20 H20 Fe O2 - |
| Calculated formula | - C20 H20 Fe O2 - |
| Title of publication | Ethyl and isopropyl 4-ferrocenylbenzoate |
| Authors of publication | Anderson, Frankie P.; Gallagher, John F.; Kenny, Peter T. M.; Ryan, Clodagh; Savage, David |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2003 |
| Journal volume | 59 |
| Pages of publication | m13 - m15 |
| a | 9.3406 ± 0.0009 Å |
| b | 10.1663 ± 0.0006 Å |
| c | 17.9072 ± 0.001 Å |
| α | 90° |
| β | 90.136 ± 0.006° |
| γ | 90° |
| Cell volume | 1700.5 ± 0.2 Å3 |
| Cell temperature | 294 ± 1 K |
| Ambient diffraction temperature | 294 ± 1 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21/a 1 |
| Hall symmetry space group | -P 2yab |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |