5'-O-(2-Amino-2-Oxoethyl)-8-(Methylamino)Adenosine

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Properties Simple | Detailed

Formula C13H19N7O5
IUPAC Name 2-[[(2r,3s,4r,5r)-5-[6-amino-8-(methylamino)purine-1,3,7-triium-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]acetamide
Molecular Mass 353.334 g·mol−1
Heat of Formation -625.0 ± 16.7 kJ·mol−1
Dipole Moment 1.84 ± 1.08 D
Volume 384.45 Å 3
Surface Area 330.82 Å 2
HOMO Energy -8.38 ± 0.55 eV
LUMO Energy 2.72 ± eV
Point Group Symmetry C1
InChIKey YTEPWBADDXGTBX-JJNLEZRASA-N
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