4-(2-Ethynyl-5-Nitro-3-Furyl)-6-Methyl-5H-Pyrimidine-1,3-Diium-5-Id-2-Amine

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Formula C11H9N4O3
IUPAC Name 4-(2-ethynyl-5-nitro-3-furyl)-6-methyl-5h-pyrimidine-1,3-diium-5-id-2-amine
Molecular Mass 245.214 g·mol−1
Heat of Formation 345.2 ± 16.7 kJ·mol−1
Dipole Moment 5.56 ± 1.08 D
Volume 270.55 Å 3
Surface Area 260.38 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy 1.46 ± eV
Point Group Symmetry C1
InChIKey VQTIIFADNKKUHM-UHFFFAOYSA-N
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