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2-[(1,3-Benzodioxol-5-yl-methyl-idene)amino]-4,5,6,7-tetra-hydro-1-benzothio-phene-3-carbonitrile.

ABSTRACT: The title compound, C(17)H(14)N(2)O(2)S, crystallizes with two roughly planar mol-ecules in the asymmetric unit, in which the dihedral angles between the 1,3-benzodioxole-5-carbaldehyde moiety and the heterocyclic five-membered ring are 3.76?(5) and 5.33?(12)°. In each mol-ecule, a short C-H?S contact generates an S(5) ring. In the crystal, pairs of mol-ecules are linked by a weak C-H?N inter-action, forming dimers.

SUBMITTER: Asiri AM

PROVIDER: S-EPMC3213598 | biostudies-literature | 2011 Aug

REPOSITORIES: biostudies-literature

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2-[(1,3-Benzodioxol-5-yl-methyl-idene)amino]-4,5,6,7-tetra-hydro-1-benzothio-phene-3-carbonitrile.

Asiri Abdullah M AM Khan Salman A SA Tahir M Nawaz MN

Acta crystallographica. Section E, Structure reports online 20110730 Pt 8

The title compound, C(17)H(14)N(2)O(2)S, crystallizes with two roughly planar mol-ecules in the asymmetric unit, in which the dihedral angles between the 1,3-benzodioxole-5-carbaldehyde moiety and the heterocyclic five-membered ring are 3.76 (5) and 5.33 (12)°. In each mol-ecule, a short C-H⋯S contact generates an S(5) ring. In the crystal, pairs of mol-ecules are linked by a weak C-H⋯N inter-action, forming dimers. ...[more]

PMID: 22091175

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