2-{[(2,6-Diamino-4-Oxo-3,4-Dihydro-8-Quinazolinyl)Methyl]Sulfanyl}-N,N-Dimethylethanaminium

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Formula C13H20N5OS
IUPAC Name 2,6-diamino-8-[2-(dimethylamino)ethylsulfanylmethyl]-3h-quinazolin-1-ium-6-id-4-one
Molecular Mass 294.396 g·mol−1
Heat of Formation -19.8 ± 16.7 kJ·mol−1
Dipole Moment 3.12 ± 1.08 D
Volume 351.32 Å 3
Surface Area 326.49 Å 2
HOMO Energy -8.12 ± 0.55 eV
LUMO Energy 2.42 ± eV
Point Group Symmetry C1
InChIKey FDIXHXDLCOSDFY-UHFFFAOYSA-O
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