2-(2-Furyl)-7-(2-Phenylethyl)-[1,2,4]Triazolo[Blah]Pyrazolo[Blah]Pyrimidin-4-Ium-6A-Id-5-Amine

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Formula C18H18N7O
IUPAC Name 2-(2-furyl)-7-(2-phenylethyl)-[1,2,4]triazolo[blah]pyrazolo[blah]pyrimidin-4-ium-6a-id-5-amine
Molecular Mass 348.382 g·mol−1
Heat of Formation 597.2 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 396.03 Å 3
Surface Area 331.52 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
InChIKey IVLNTWSKYCEYKV-UHFFFAOYSA-P
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