Crystal structure of 4-[(E)-(4-fluoro-benzyl-idene)amino]-3-methyl-1H-1,2,4-triazole-5(4H)-thione.

P S Manjula, B K Sarojini, B Narayana, K Byrappa, S Madan Kumar

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In one paragraph

Article in Acta crystallographica. Section E, Crystallographic communications, 2015. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 1 paper.

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1citing papers in PubMed

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3 · Its place in the literature

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1 citing paper in PubMed.

Crystal structure of (E)-3-(4-hy-droxy-benz-yl)-4-{[4-(methyl-sulfan-yl)benzyl-idene]amino}-1H-1,2,4-triazole-5(4H)-thione.Acta crystallographica. Section E, Crystallographic communications · 2015
Article

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5 · Who and what money

Authors and funding

5 authors.

P S ManjulaDepartment of Chemistry, P A College of Engineering, Nadupadavu 574 153, D.K., Mangaluru, India.

B K SarojiniDepartment of Industrial Chemistry, Mangalagangotri, Mangalore University, Mangaluru 574 199, India.

B NarayanaDepartment of Chemistry, Mangalagangotri, Mangalore University, Mangaluru 574 199, India.

K ByrappaDepartment of Materials Science, Mangalagangotri, Mangalore University, Mangaluru 574 199, India.

S Madan KumarPURSE Lab, Mangalagangotri, Mangalore University, Mangaluru 574 199, India.

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

The title compound, C10H9FN4S, crystallizes with two mol-ecules (A and B) in the asymmetric unit. The dihedral angle between the planes of the trizole and fluoro-benzene rings is 7.3 (3)° in mol-ecule A and 41.1 (3)° in mol-ecule B. Mol-ecule A features an intra-molecular C-H⋯S hydrogen bond, which closes an S(6) ring. In the crystal, A+B dimers linked by pairs of N-H⋯S hydrogen bonds occur, generating R 2 (2)(8) loops. Weak π-π stacking contacts [centroid-centroid separation = 3.739 (6) Å] are also observed.

Indexed as

1,2,4-triazole-5(4H)-thioneC—H⋯S hydrogen bondcrystal structurefluorobenzeneN—H⋯S hydrogen bondπ–π stacking contacts

Identifiers

PMID26870523

DOI10.1107/S2056989015020125

PMCPMC4719876

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