Crystal Structure Of 4-(3,4-DiCyanoPhenOxy)-N-[3-(DiMethylAmino)PropYl]Benzamide MonoHydrate: A PhenOxyPhthaloNitrile Derivative
Date
2015Author
Çolak, Senem
Yıldız, Salih Zeki
Delibaş, Çaylak N.
Pişkin, H.
Hökelek, Tuncer
Eroe, J.
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In the title compound, the planes of the phenoxy and phthalonitrile rings are oriented at a dihedral angle of 60.39 (5)°. In the crystal, molecules are linked by O—H⋯O, O—H⋯N and N—H⋯O hydrogen bonds, forming slabs parallel to (100). The slabs are linked by a pair of inversion-related C—H⋯N hydrogen bonds, forming a three-dimensional structure., In the title compound, C20H20N4O2·H2O, the planes of the phenoxy and phthalonitrile rings are oriented at a dihedral angle of 60.39 (5)°. The 3-(dimethylamino)propyl chain has an extended conformation and is cis with respect to the phthalonitrile ring. In the crystal, O—H⋯O, O—H⋯N and N—H⋯O hydrogen bonds link the molecules to form slabs parallel to (100). There are also C—H⋯O and C—H⋯N hydrogen bonds and C—H⋯π interactions present within the slabs. The slabs are linked by a pair of inversion-related C—H⋯N hydrogen bonds, involving phthalonitrile rings, forming a three-dimensional structure.
URI
https://doi.org/10.1107/S2056989015014991https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4555371/
http://hdl.handle.net/11655/18220