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

Devarajegowda HC, Jeyaseelan S, Sathishkumar R, D'souza AS, D'souza A - Acta Crystallogr Sect E Struct Rep Online (2012)

Bottom Line: In the asymmetric unit of the title compound, C(10)H(9)FN(4)S, there are two independent mol-ecules in which the dihedral angles between the 1,2,4-triazole and benzene rings are 36.85 (10) and 7.81 (10)°.In the crystal, N-H⋯S inter-actions link pairs of independent mol-ecules into dimers.There are also π-π inter-actions between the triazole and benzene rings of inversion-related pairs of the more planar mol-ecule [centroid-centroid distance = 3.6430 (13) Å].

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ABSTRACT
In the asymmetric unit of the title compound, C(10)H(9)FN(4)S, there are two independent mol-ecules in which the dihedral angles between the 1,2,4-triazole and benzene rings are 36.85 (10) and 7.81 (10)°. In the crystal, N-H⋯S inter-actions link pairs of independent mol-ecules into dimers. There are also π-π inter-actions between the triazole and benzene rings of inversion-related pairs of the more planar mol-ecule [centroid-centroid distance = 3.6430 (13) Å].

No MeSH data available.


The molecular structure of the title compound. Displacement ellipsoids are drawn at the 50% probability level.
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Fap1: The molecular structure of the title compound. Displacement ellipsoids are drawn at the 50% probability level.


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

Devarajegowda HC, Jeyaseelan S, Sathishkumar R, D'souza AS, D'souza A - Acta Crystallogr Sect E Struct Rep Online (2012)

The molecular structure of the title compound. Displacement ellipsoids are drawn at the 50% probability level.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3379215&req=5

Fap1: The molecular structure of the title compound. Displacement ellipsoids are drawn at the 50% probability level.
Bottom Line: In the asymmetric unit of the title compound, C(10)H(9)FN(4)S, there are two independent mol-ecules in which the dihedral angles between the 1,2,4-triazole and benzene rings are 36.85 (10) and 7.81 (10)°.In the crystal, N-H⋯S inter-actions link pairs of independent mol-ecules into dimers.There are also π-π inter-actions between the triazole and benzene rings of inversion-related pairs of the more planar mol-ecule [centroid-centroid distance = 3.6430 (13) Å].

View Article: PubMed Central - HTML - PubMed

ABSTRACT
In the asymmetric unit of the title compound, C(10)H(9)FN(4)S, there are two independent mol-ecules in which the dihedral angles between the 1,2,4-triazole and benzene rings are 36.85 (10) and 7.81 (10)°. In the crystal, N-H⋯S inter-actions link pairs of independent mol-ecules into dimers. There are also π-π inter-actions between the triazole and benzene rings of inversion-related pairs of the more planar mol-ecule [centroid-centroid distance = 3.6430 (13) Å].

No MeSH data available.