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CIF Information Card
Information card for 2012527
2012526 << 2012527 >> 2012528Preview
|
Coordinates |
2012527.cif |
|
Structure factors |
2012527.hkl |
Structure parameters
| Formula | - C7 H5 F3 N2 O2 - |
| Calculated formula | - C7 H5 F3 N2 O2 - |
| Title of publication | Hydrogen bonding in C-substituted nitroanilines: molecular ladders in 2-trifluoromethyl-4-nitroaniline and sheets of R~4~^4^(12) and R~4~^4^(32) rings in 3-trifluoromethyl-4-nitroaniline |
| Authors of publication | Glidewell, Christopher; Low, John N.; McWilliam, Susan A.; Skakle, Janet M. S.; Wardell, James L. |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2002 |
| Journal volume | 58 |
| Pages of publication | o97 - o99 |
| a | 7.1048 ± 0.0002 Å |
| b | 15.3832 ± 0.0005 Å |
| c | 14.3091 ± 0.0006 Å |
| α | 90° |
| β | 91.9102 ± 0.0012° |
| γ | 90° |
| Cell volume | 1563.04 ± 0.09 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |