201025-28-7Relevant academic research and scientific papers
Synthesis and structural characterization of N-amino compounds
Li, Ya-Nan,Liu, Ning,Su, Peng-Fei,Wang, Ying-Lei,Ge, Zhong-Xue,Li, Hui,Wang, Bo-Zhou
, p. 7151 - 7156 (2014)
Seven N-amino compounds were successfully synthesized via N-amination reaction. The structures of target compounds and intermediates were characterized by 1H NMR, 13C NMR, IR, elementary analysis, MS and X-ray single-crystal diffraction analysis. The single crystals of 3,5-diamino-1,2,4-triazole and 3,5-dinitro-1,2,4-triazole were obtained. Crystal data of 3,5-diamino-1,2,4-triazole: C2H5N5, Mr = 99.11, Monoclinic, P2(1)/c, a = 10.652(4), b = 4.3411(14), c = 10.822(4) ?, α = 90(4), β = 118.714(4), γ = 90deg;, V = 0.4389(2) nm3, Z = 4, Dc = 1.500 g cm-3, μ = 0.113 mm-1, F(000) = 208, R = 0.0354 and wR = 0.0936. Crystal data of 3,5-dinitro-1,2,4-triazole: C2H3N5O5, Mr = 177.09, Orthorhombic, P2(1)2(1)2(1), a = 4.937(3), b = 9.344(5), c = 140447(7) ?, α = 90, β = 90, γ = 90°, V = 0.6665(6) nm3, Z = 4, Dc = 1.765 g cm-3, μ = 0.171 mm-1, F(000) = 360, R = 0.0555 and wR = 0.1772.
Chemistry of furazano[3,4-b]pyrazine. 1. Synthesis and thermodynamic appraisal of 4,8-dihydrodifurazano[3,4-b,e]pyrazine and its derivatives
Starchenkov,Andrianov,Mishnev
, p. 216 - 228 (2007/10/03)
The thermodynamic stability of the antiaromatic 4,8-dihydrodifurazano[3,4-b,e]pyrazine (I) was studied by a quantum-chemical method. The molecular structure was investigated by x-ray crystallographic analysis, and the aromaticity index of the compound was
