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Crystal structure of 5-(4-benzyl-oxyphen-yl)-3-(4-meth-oxy-phen-yl)-6-methyl-cyclo-hex-2-en-1-one.

ABSTRACT: The title compound, C27H26O3, crystallized with two independent mol-ecules (A and B) in the asymmetric unit. In mol-ecule A, the plane of the central benzene ring forms dihedral angles of 75.78 (14) and 52.75 (16)° with that of the terminal benzene rings, and the dihedral angle between the planes of the terminal benzene rings is 51.49 (17)°. The corresponding values for mol-ecule B are 75.18 (14), 58.11 (16) and 47.91 (16)°, respectively. The cyclo-hexene ring adopts an envelope conformation in both mol-ecules, with the C atom to which is attached the central benzene ring as the flap. The crystal packing, is stabilized by C-H⋯π inter-actions.

SUBMITTER: Sathya S 

PROVIDER: S-EPMC4331857 | biostudies-literature | 2015 Jan

REPOSITORIES: biostudies-literature

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Crystal structure of 5-(4-benzyl-oxyphen-yl)-3-(4-meth-oxy-phen-yl)-6-methyl-cyclo-hex-2-en-1-one.

Sathya S S   Reuben Jonathan D D   Sidharthan J J   Vasanthi R R   Usha G G  

Acta crystallographica. Section E, Crystallographic communications 20150101 Pt 1

The title compound, C27H26O3, crystallized with two independent mol-ecules (A and B) in the asymmetric unit. In mol-ecule A, the plane of the central benzene ring forms dihedral angles of 75.78 (14) and 52.75 (16)° with that of the terminal benzene rings, and the dihedral angle between the planes of the terminal benzene rings is 51.49 (17)°. The corresponding values for mol-ecule B are 75.18 (14), 58.11 (16) and 47.91 (16)°, respectively. The cyclo-hexene ring adopts an envelope conformation in  ...[more]

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