(2S,3R)-2-Amino-N-[(2S,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl]-3-Hydroxy-Butanamide

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Formula C14H21N7O5
IUPAC Name (2s,3r)-2-amino-n-[(2s,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]-3-hydroxy-butanamide
Molecular Mass 367.360 g·mol−1
Heat of Formation -700.8 ± 16.7 kJ·mol−1
Dipole Moment 4.07 ± 1.08 D
Volume 406.53 Å 3
Surface Area 352.25 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy 2.30 ± eV
Point Group Symmetry C1
InChIKey GQLCTMFFJPXYAR-JHJLZTHQSA-O
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