Formula |
C7H9N7O |
IUPAC Name |
(2s)-2-amino-3-[1-(3,4-diaza-1-azonia-2-azanidacyclopenta-3,5-dien-5-yl)imidazol-1-ium-3-id-4-yl]propanal |
Molecular Mass |
207.193 g·mol−1 |
Heat of Formation |
385.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.06 ± 1.08 D |
Volume |
236.24 Å 3 |
Surface Area |
226.81 Å 2 |
HOMO Energy |
-9.81 ± 0.55 eV |
LUMO Energy |
-1.54 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OOFNCFXOGMDAEN-YFKPBYRVSA-N |
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Elements |
H
C
O
N
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