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5-Cyclo-pentyl-2-methyl-3-(3-methyl-phenyl-sulfon-yl)-1-benzo-furan.

ABSTRACT: In the title compound, C21H22O3S, the five-membered ring adopts an envelope conformation with the ipso atom deviating by 0.596?(2)?Å from the plane through the rest of the ring atoms. The dihedral angle between the mean planes of the benzo-furan and m-tolyl moieties is 78.4?(1)°. In the crystal, mol-ecules related by a glide plane are linked via C-H?O hydrogen bonds into chains along the a-axis direction. These chains are in turn connected by C-H?? inter-actions into layers parallel to the ac plane.

SUBMITTER: Choi HD

PROVIDER: S-EPMC3998559 | biostudies-literature | 2014 Apr

REPOSITORIES: biostudies-literature

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5-Cyclo-pentyl-2-methyl-3-(3-methyl-phenyl-sulfon-yl)-1-benzo-furan.

Choi Hong Dae HD Seo Pil Ja PJ Lee Uk U

Acta crystallographica. Section E, Structure reports online 20140326 Pt 4

In the title compound, C21H22O3S, the five-membered ring adopts an envelope conformation with the ipso atom deviating by 0.596 (2) Å from the plane through the rest of the ring atoms. The dihedral angle between the mean planes of the benzo-furan and m-tolyl moieties is 78.4 (1)°. In the crystal, mol-ecules related by a glide plane are linked via C-H⋯O hydrogen bonds into chains along the a-axis direction. These chains are in turn connected by C-H⋯π inter-actions into layers parallel to the ac pl ...[more]

PMID: 24826175

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