Crystal Structure of Methyl 2-(Benzyloxy)benzoate

J. Jasinski, R. Butcher, M. Swamy, H. Yathirajan, K. Mohana, B. Narayana
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Abstract

The title compound, C15H14O3, crystallizes in the monoclinic space group P21/c with unit-cell parameters a = 12.8201(9), b = 12.3985(11), c = 7.6257(6)A, β = 90.930(9)°, Z = 4. The dihedral angle between the mean planes of the methyl-2benzoate ring and the benzyloxy ring is 8.0(2)°. Intermolecular hydrogen-bonding C-H…O interactions and π-π stacking interactions between nearby benzoate rings influence the twist angle between these two groups, and help to stabilize the crystal packing in the unit cell.
2-(苄氧基)苯甲酸甲酯的晶体结构
化合物C15H14O3在单斜空间群P21/c中结晶,晶胞参数a = 12.8201(9), b = 12.3985(11), c = 7.6257(6) a, β = 90.930(9)°,Z = 4。苯甲酸甲酯环和苯氧基环的平均平面之间的二面角为8.0(2)°。分子间氢键C-H - O相互作用和附近苯甲酸酯环之间的π-π堆积相互作用影响这两个基团之间的扭转角,有助于稳定晶胞内的晶体堆积。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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