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1-Methyl-4-({5-[(4-methyl-phen-yl)sulfan-yl]pent-yl}sulfan-yl)benzene.

ABSTRACT: There are two independent mol-ecules in the asymmetric unit of the title compound, C(19)H(24)S(2). In both mol-ecules, the aliphatic segment of the ligand is in an all-trans conformation: the -S-(CH(2))(5)-S-bridging chain is almost planar (r.m.s. deviation for all non-H atoms = 0.0393 and 0.0796?Å in the two mol-ecules) and maximally extended. Their mean planes form dihedral angles of 4.08?(6)/20.47?(6) and 2.22?(6)/58.19?(6)° with the aromatic rings in the two mol-ecules. The crystal packing is purely governed by weak inter-molecular forces.

SUBMITTER: Brito I

PROVIDER: S-EPMC2972162 | biostudies-literature | 2009 Nov

REPOSITORIES: biostudies-literature

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1-Methyl-4-({5-[(4-methyl-phen-yl)sulfan-yl]pent-yl}sulfan-yl)benzene.

Brito Iván I Cárdenas Alejandro A Albanez Joselyn J Bolte Michael M López-Rodríguez Matías M

Acta crystallographica. Section E, Structure reports online 20091104 Pt 12

There are two independent mol-ecules in the asymmetric unit of the title compound, C(19)H(24)S(2). In both mol-ecules, the aliphatic segment of the ligand is in an all-trans conformation: the -S-(CH(2))(5)-S-bridging chain is almost planar (r.m.s. deviation for all non-H atoms = 0.0393 and 0.0796 Å in the two mol-ecules) and maximally extended. Their mean planes form dihedral angles of 4.08 (6)/20.47 (6) and 2.22 (6)/58.19 (6)° with the aromatic rings in the two mol-ecules. The crystal packing i ...[more]

PMID: 21578720

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