In the title compound, C 14 H 10 N 2 O 4 S, the nitro group, confirmed as being in the 6-position, is coplanar with the indole ring system and the angle between the planes of the indole system and the phenyl ring is 96.1 (1) .
6-Nitro-2-propyl-1H-indole
✍ Scribed by Huang, Xianghong ;Zhang, Qian-Feng ;Sung, Herman H. Y.
- Publisher
- International Union of Crystallography
- Year
- 2004
- Tongue
- English
- Weight
- 227 KB
- Volume
- 60
- Category
- Article
- ISSN
- 1600-5368
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📜 SIMILAR VOLUMES
In the title molecule, C 17 H 14 N 2 O 2 , the indole ring system is essentially planar and makes a dihedral angle of 87.93 (3) with the plane of the benzene ring. The nitrovinyl double bond adopts the E geometry.
The crystal structure of the title compound, C 14 H 10 N 2 O 4 S, confirms the position of the nitro group at position C-3 of the indole ring system. While the nitro group is coplanar with the indole ring system, the angle between the indole and phenyl planes is 83.9 (3) .
In the title structure, C 16 H 12 N 4 O 3 Á0.5H 2 O, the uncoordinated water molecule lies on a special position of site symmetry 2; O-HÁ Á ÁO and N-HÁ Á ÁO hydrogen bonds link the water and organic molecules into a layer structure.