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CIF Information Card
Information card for 2013865
2013864 << 2013865 >> 2013866Preview
|
Coordinates |
2013865.cif |
|
Structure factors |
2013865.hkl |
Structure parameters
| Formula | - C7 H8 N2 O4 S - |
| Calculated formula | - C7 H8 N2 O4 S - |
| Title of publication | Hydrogen bonding in C-substituted nitroanilines: a chain of R~3~^3^(12) rings in 2-methanesulfonyl-4-nitroaniline |
| Authors of publication | Howie, R. Alan; Low, John N.; Wardell, James L.; Glidewell, Christopher |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2004 |
| Journal volume | 60 |
| Pages of publication | o84 - o86 |
| a | 15.8657 ± 0.0005 Å |
| b | 7.2366 ± 0.0001 Å |
| c | 16.4224 ± 0.0005 Å |
| α | 90° |
| β | 110.304 ± 0.001° |
| γ | 90° |
| Cell volume | 1768.36 ± 0.08 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | I 1 2/c 1 |
| Hall symmetry space group | -I 2yc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |