Abstract
In the crystal structure of the title compound, C11H13N3S, molecules form centrosymmetric synthons with an R 2 2(8) graph-set motif, linked by pairs of N—H⋯S hydrogen bonds. The synthons are connected through further N—H⋯S hydrogen bonds, extending the packing to form a two-dimensional network lying parallel to (001). In addition, C—H⋯π interactions are observed.
Highlights
In the crystal structure of the title compound, C11H13N3S, molecules form centrosymmetric synthons with an R22(8)
Cg1 is the centroid of the C1–C6 ring
Symmetry codes: (i) −x+1/2, y+1/2, z; (ii) −x+1, −y, −z; (iii) −x+1, y−1/2, −z+1/2
Summary
Cg1 is the centroid of the C1–C6 ring. Departamento de Quımica Fısica y Analıtica, Facultad de Quımica, Universidad de Oviedo – CINN, C/ Julián Claverıa, 8, 33006 Oviedo, Spain. Symmetry codes: (i) x þ 12; y þ 12; z; (ii) x þ 1; y; z; (iii) x þ 1; y 12; z þ 12. Data collection: CrysAlis CCD (Oxford Diffraction, 2010); cell refinement: CrysAlis CCD; data reduction: CrysAlis RED Diffraction, 2010); program(s) used to solve structure: SIR92 (Altomare et al, 1994); program(s) used to refine structure: SHELXL97. In the crystal structure of the title compound, C11H13N3S, molecules form centrosymmetric synthons with an R22(8). Graph-set motif, linked by pairs of N—H S hydrogen bonds. The synthons are connected through further N—H S hydrogen bonds, extending the packing to form a twodimensional network lying parallel to (001).
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