Methyl (E)-2-[(2-nitro-phen-oxy)meth-yl]-3-phenyl-acrylate.
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The title compound, C(17)H(15)NO(5), adopts an E conformation with respect to the C=C double bond of the phenyl-acrylate unit.The phenyl ring and methyl acrylate group of the phenyl-acrylate unit are disordered over two sets of sites with site-occupancy ratios of 0.705 (5):0.295 (5) and 0.683 (3):0.317 (3), respectively.Intra-molecular C-H⋯O interactions stabilise the molecular structure.
ABSTRACT
The title compound, C(17)H(15)NO(5), adopts an E conformation with respect to the C=C double bond of the phenyl-acrylate unit. The phenyl ring and methyl acrylate group of the phenyl-acrylate unit are disordered over two sets of sites with site-occupancy ratios of 0.705 (5):0.295 (5) and 0.683 (3):0.317 (3), respectively. The mean plane through the benzene ring of the phenyl acrylate makes dihedral angles of 88.4 (8) (major component) and 86.7 (8)° (minor component) with the nitro-phen-oxy ring; the dihedral angle between the two components is 3.64 (6)°. Intra-molecular C-H⋯O interactions stabilise the molecular structure. In the crystal, C-H⋯O inter-actions result in a chain of mol-ecules running along the b axis. No MeSH data available. Related in: MedlinePlus |
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Fap1: Molecular structure of the title compound, showing the atom - numbering scheme with 30% probability displacement ellipsoids. H atoms are shown as spheres of arbitrary radius. The minor fractions of the disordered benzene ring and methylacrylate have been represented by broken bonds. |
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