The crystal structure of 5-methyl-3-nitro-1,2,3triazolo1,5-b1,2,4triazine | Synapse
July 6, 2026Open Access
The crystal structure of 5-methyl-3-nitro-1,2,3triazolo1,5-b1,2,4triazine
Key Points
To determine the crystal structure of 5-methyl-3-nitro-[1,2,3]triazolo[1,5-b][1,2,4]triazine.
Utilized X-ray diffraction to analyze the crystal structure.
Measured unit cell parameters: a = 21.2876 Å, c = 8.7733 Å, V = 3443.1 ų.
Refined data showing Rgt(F) = 0.0496, wR(ref)(F²) = 0.1301.
Crystal structure was found to be trigonal with a symmetry of R3‾.
Molecular formula confirmed as C5H4N6O2.
Temperature of measurement was stable at 293 K.
Abstract
Abstract C 5 H 4 N 6 O 2 , trigonal, R 3‾ (no. 148), a = 21.2876(17) Å, c = 8.7733(11) Å, V = 3443.1(7) Å 3 , Z = 18, R gt ( F ) = 0.0496, wR ref ( F 2 ) = 0.1301, T = 293 K.