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1,4-Bis(pyrimidin-2-yl-sulfanyl)-butane.

ABSTRACT: The -SCH(2)CH(2)CH(2)CH(2)S- portion of the title compound, C(12)H(14)N(2)S(2), adopts an extended zigzag conformation. The angles at the tetra-hedral carbon atoms are marginally increased [113.63?(12)° and 111.38?(17)° for S-C-C and C-C-C respectively] from the idealized tetra-hedral angle. The mol-ecule lies on an inversion center located at the mid-point of the butyl chain. In the crystal, there is a ?-? stacking inter-action between inversion-related pyrimidine rings with mean inter-planar spacing of 3.494?(2)?Å.

SUBMITTER: Akbar M 

PROVIDER: S-EPMC3009222 | biostudies-literature | 2010 Oct

REPOSITORIES: biostudies-literature

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1,4-Bis(pyrimidin-2-yl-sulfanyl)-butane.

Akbar Muhammad M   Quereshi Fahim Ashraf FA   Nasir Waqar W   Adnan Ahmad A   Ng Seik Weng SW  

Acta crystallographica. Section E, Structure reports online 20101020 Pt 11

The -SCH(2)CH(2)CH(2)CH(2)S- portion of the title compound, C(12)H(14)N(2)S(2), adopts an extended zigzag conformation. The angles at the tetra-hedral carbon atoms are marginally increased [113.63 (12)° and 111.38 (17)° for S-C-C and C-C-C respectively] from the idealized tetra-hedral angle. The mol-ecule lies on an inversion center located at the mid-point of the butyl chain. In the crystal, there is a π-π stacking inter-action between inversion-related pyrimidine rings with mean inter-planar s  ...[more]

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