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[(1*,3*,4*)-3-(2-Hy-droxy-benzo-yl)-1,2,3,4-tetra-hydro-1,4-ep-oxy-naphthalen-1-yl]methyl 4-nitro-benzoate. | LitMetric
The relative stereo- and regiochemistry of the racemic title compound, CHNO, were established from the crystal structure. The fused benzene ring forms dihedral angles of 77.3 (1) and 60.3 (1)° with the hy-droxy-substituted benzene ring and the nitro-substituted benzene ring, respectively. The dihedral angle between the hy-droxy-substituted benzene ring and the nitro-substituted benzene ring is 76.4 (1)°. An intra-molecular O-H⋯O hydrogen bond closes an (6) ring. In the crystal, weak C-H⋯O hydrogen bonds connect the mol-ecules, forming layers parallel to (100). Within these layers, there are weak π-π stacking inter-actions with a ring centroid-ring centroid distance of 3.555 (1) Å.
Publication Analysis
Top Keywords
hy-droxy-substituted benzene
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nitro-substituted benzene
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[1*3*4*-3-2-hy-droxy-benzo-yl-1234-tetra-hydro-14-ep-oxy-naphthalen-1-yl]methyl 4-nitro-benzoate
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4-nitro-benzoate relative
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