4a-Hydroxy-9-(2-methoxyphenyl)-4,4a, 5,6,7,8,9,9a-octahydro-3H-xanthene-1,8(2H)-dione

作者:Loh Wan Sin; Fun Hoong Kun*; Reddy B Palakshi; Vijayakumar V; Sarveswari S
来源:Acta Crystallographica Section E-Structure Reports Online, 2011, 67: O35-U1600.
DOI:10.1107/S1600536810050191

摘要

In the title compound, C20H22O5, an S(6) ring motif is formed by an intramolecular C-H center dot center dot center dot O hydrogen bond, which contributes to the stabilization of the molecule. In the xanthene system, the cyclohexane ring adopts a chair conformation, the cyclohexene ring adopts a half-boat conformation and the tetrahydropyran ring adopts a half-chair conformation. The mean plane of the four essentially planar atoms of the tetrahydropyran ring [r.m.s deviation = 0.092 (1) angstrom] forms a dihedral angle of 64.13 (6)degrees with the mean plane of the methoxyphenyl group. In the crystal, intermolecular O-H center dot center dot center dot O and weak C-H center dot center dot center dot O hydrogen bonds link molecules into chains along the a axis, which are further stabilized by C-H center dot center dot center dot pi interactions.

  • 出版日期2011-1

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