Saeed Aamer, Arshad Ifzan, Flörke Ulrich
Acta Crystallogr Sect E Struct Rep Online. 2012 Aug 1;68(Pt 8):o2418. doi: 10.1107/S1600536812030619. Epub 2012 Jul 10.
In the title compound, C(13)H(10)N(4)O(5), the aromatic ring planes are close to perpendicular [dihedral angle = 75.94 (5)°] and the C-N-N-C torsion angle is 88.7 (2)°. Both nitro groups lie close to their attached ring plane, with C-C-N-O torsion angles of 3.1 (2) and 5.3 (2)°. This allows for the formation of an intra-molecular N-H⋯O hydrogen bond, which closes an S(6) ring. In the crystal, N-H⋯O hydrogen bonds link the mol-ecules into zigzag chains extending along [100].
在标题化合物C(13)H(10)N(4)O(5)中,芳环平面接近垂直[二面角 = 75.94 (5)°],C-N-N-C扭转角为88.7 (2)°。两个硝基都靠近与其相连的环平面,C-C-N-O扭转角分别为3.1 (2)°和5.3 (2)°。这使得形成了一个分子内N-H⋯O氢键,该氢键形成了一个S(6)环。在晶体中,N-H⋯O氢键将分子连接成沿[100]方向延伸的锯齿链。