Formula |
C14H13N9 |
IUPAC Name |
3-(6-amino-2-methyl-pyrimidin-4-yl)-n-pyrazol-2-ium-1-id-3-yl-imidazo[1,2-b]pyridazin-4-ium-3-ylium-2-amine |
Molecular Mass |
307.313 g·mol−1 |
Heat of Formation |
712.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.37 ± 1.08 D |
Volume |
342.6 Å 3 |
Surface Area |
321.86 Å 2 |
HOMO Energy |
-8.43 ± 0.55 eV |
LUMO Energy |
0.92 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
PQQNUIZZMSTORP-UHFFFAOYSA-N |
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Elements |
H
C
N
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