Adabi Ardakani Amir, Kargar Hadi, Kia Reza, Tahir Muhammad Nawaz
Acta Crystallogr Sect E Struct Rep Online. 2012 Feb 1;68(Pt 2):o340-1. doi: 10.1107/S1600536812000487. Epub 2012 Jan 11.
The title compound, C(10)H(13)N(3)O(2)S, crystallizes with two independent mol-ecules (A and B) in the asymmetric unit. In the crystal, the A and B mol-ecules are linked via pairs of N-H⋯O and O-H⋯S hydrogen bonds, forming dimers with R(2) (2)(14) and R(2) (2)(6) ring motifs. These dimers are linked via a pair of N-H⋯S hydrogen bonds with an R(2) (2)(8) ring motif, forming chains propagating along the c-axis direction. The crystal was refined as an inversion twin with a final BASF ratio of 0.54 (11):0.46 (11).
标题化合物C(10)H(13)N(3)O(2)S在不对称单元中以两个独立分子（A和B）结晶。在晶体中，A分子和B分子通过N-H⋯O和O-H⋯S氢键对相连，形成具有R(2) (2)(14)和R(2) (2)(6)环 motif的二聚体。这些二聚体通过一对具有R(2) (2)(8)环 motif的N-H⋯S氢键相连，形成沿c轴方向延伸的链。该晶体被精修为一个倒易孪晶，最终的BASF比率为0.54 (11):0.46 (11)。
