[(3Ar)-3,8-Dimethyl-3Ah-Imidazo[4,5-F]Quinoxaline-1,6,9-Triium-2-Yl]-[2-Amino-6-Oxo-9-[(2R,4R,5S)-4-Phosphonooxy-5-(Phosphonooxymethyl)Tetrahydrofuran-2-Yl]-3H-Purine-1,7-Diium-4-Id-8-Yl]Azanide

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Formula C21H26N10O10P2
IUPAC Name [(3ar)-3,8-dimethyl-3ah-imidazo[4,5-f]quinoxaline-1,6,9-triium-2-yl]-[2-amino-6-oxo-9-[(2r,4r,5s)-4-phosphonooxy-5-(phosphonooxymethyl)tetrahydrofuran-2-yl]-3h-purine-1,7-diium-4-id-8-yl]azanide
Molecular Mass 640.440 g·mol−1
Heat of Formation -1616.7 ± 16.7 kJ·mol−1
Dipole Moment 16.22 ± 1.08 D
Volume 662.41 Å 3
Surface Area 530.97 Å 2
HOMO Energy -8.21 ± 0.55 eV
LUMO Energy -1.71 ± eV
Point Group Symmetry C1
InChIKey MHMMYARFECDAKF-FVCCEPFGSA-P
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