1-(4-Amino-6-Methyl-1,3,5-Triazin-2-Yl)-N-(1H-Pyrazol-3-Yl)-1H-Benzimidazol-2-Amine

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Properties Simple | Detailed

Formula C14H13N9
IUPAC Name 1-(4-amino-6-methyl-1,3,5-triazin-2-yl)-n-(4h-pyrazol-1-ium-4-id-3-yl)benzimidazol-1-ium-2-ylium-2-amine
Molecular Mass 307.313 g·mol−1
Heat of Formation 611.4 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 340.9 Å 3
Surface Area 316.03 Å 2
HOMO Energy -8.20 ± 0.55 eV
LUMO Energy 1.19 ± eV
Point Group Symmetry C1
InChIKey DMMFPXAFVNDPCA-UHFFFAOYSA-N
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Elements H C N