(2Z)-N-(3-Nitrophenyl)-4-[3-(1H-1,2,4-Triazol-1-Ylmethyl)Phenyl]-2(5H)-Pyrimidinimine

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Formula C19H14N7O2
IUPAC Name [4-[3-(diazet-3-yl)phenyl]-5h-pyrimidine-1,3-diium-2-yl]-(3-nitrophenyl)azanide; formonitrile; hydron
Molecular Mass 374.376 g·mol−1
Heat of Formation 984.2 ± 16.7 kJ·mol−1
Dipole Moment 10.59 ± 1.08 D
Volume 434.35 Å 3
Surface Area 402.03 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy -0.04 ± eV
Point Group Symmetry C1
InChIKey PLQVWKCQWFFUFJ-NMWGTECJSA-N
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