N-(2-Methyl-2-Propanyl)-2-(5,6,7,8-Tetrahydroimidazo[1,5-A]Pyridin-1-Yl)-5H-Pyrrolo[2,3-B]Pyrazine-7-Carboxamide

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Properties Simple | Detailed

Formula C18H22N6O
IUPAC Name n-tert-butyl-2-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-4-ium-2-id-1-yl)pyrrolo[2,3-b]pyrazin-5-ium-4-ide-7-carboxamide
Molecular Mass 338.407 g·mol−1
Heat of Formation 108.0 ± 16.7 kJ·mol−1
Dipole Moment 4.30 ± 1.08 D
Volume 413.25 Å 3
Surface Area 352.74 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
InChIKey NEVNJCLJFXHCCC-UHFFFAOYSA-N
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