1,3-Bis(chloromethyl)-2-methyl-5-nitrobenzene

oleh: Chang-Yun Wang, Mei-Yan Wei, Zhen Liu, Chunyuan Li, Chang-Lun Shao

Format: Article
Diterbitkan: International Union of Crystallography 2008-04-01

Deskripsi

The title compound, C9H9Cl2NO2, is a natural product isolated from the endophytic fungus No. B77 of the mangrove tree from the South China Sea coast. In the crystal structure, the molecules lie on twofold axes and form offset stacks through face-to-face π–π interactions. Adjacent molecules in each stack are related by a centre of inversion and have an interplanar separation of 3.53 (1) Å, with a centroid–centroid distance of 3.76 (1) Å. Between stacks, there are C—H...O interactions to the nitro groups and Cl...Cl contacts of 3.462 (1) Å.