Rabnawaz Muhammad, Raza Shah Muhammad, Ng Seik Weng
Acta Crystallogr Sect E Struct Rep Online. 2010 Sep 15;66(Pt 10):o2569. doi: 10.1107/S1600536810035713.
The title compound, C(20)H(16)Cl(2)N(4)O, has two mol-ecules in the asymmetric unit. The two five-membered rings form a dihedral angle of 54.2 (3)° in one mol-ecule and 56.8 (3)° in the other independent mol-ecule. The amino group of the dihydro-pyrazolone unit of one mol-ecule acts as a hydrogen-bond donor to the carbonyl group of the dihydro-pyrazolone system of the other mol-ecule. The resulting N-H⋯O hydrogen bonds generate a chain running along the c axis. The crystal selected was a pseudo-merohedral twin with a 44.9 (3)% twin component.
标题化合物C(20)H(16)Cl(2)N(4)O的不对称单元中有两个分子。在一个分子中,两个五元环形成的二面角为54.2 (3)°,在另一个独立分子中为56.8 (3)°。一个分子的二氢吡唑啉酮单元的氨基作为氢键供体与另一个分子的二氢吡唑啉酮体系的羰基形成氢键。由此产生的N-H⋯O氢键形成了一条沿c轴延伸的链。所选晶体为假半面体孪晶,孪晶组分占44.9 (3)%。