5'-[[(Z)-4-Amino-2-Butenyl]Methylamino]-5'-Deoxyadenosine

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Properties Simple | Detailed

Formula C15H23N7O3
IUPAC Name (2r,3s,4r,5r)-2-[[[(e)-4-aminobut-2-enyl]-methyl-amino]methyl]-5-(6-aminopurin-9-ium-9-yl)tetrahydrofuran-3,4-diol
Molecular Mass 349.388 g·mol−1
Heat of Formation -228.7 ± 16.7 kJ·mol−1
Dipole Moment 3.74 ± 1.08 D
Volume 408.9 Å 3
Surface Area 338.51 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
InChIKey YWJCZGDVJQLZET-YEZPCYKBSA-N
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