4-Amino-1-[(1R)-2-Deoxypentofuranosyl]-5-Iodo-2(1H)-Pyrimidinone

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Formula C9H12IN3O4
IUPAC Name 4-amino-1-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-iodo-pyrimidin-3-ium-2-one
Molecular Mass 353.114 g·mol−1
Heat of Formation -559.5 ± 16.7 kJ·mol−1
Dipole Moment 2.48 ± 1.08 D
Volume 292.31 Å 3
Surface Area 262.07 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 2.54 ± eV
Point Group Symmetry C1
InChIKey WEVJJMPVVFNAHZ-XVMARJQXSA-N
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