(2S,3S,4R,5R)-N-(2-Aminoethyl)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Carboxamide

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Formula C12H17N7O4
IUPAC Name (2s,3s,4r,5r)-n-(2-aminoethyl)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-carboxamide
Molecular Mass 323.308 g·mol−1
Heat of Formation -439.8 ± 16.7 kJ·mol−1
Dipole Moment 1.33 ± 1.08 D
Volume 357.25 Å 3
Surface Area 311.53 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
InChIKey MZIOPOVRWVEINN-FLNNQWSLSA-O
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