[(2R,3S,4R,5R)-2-(4-Amino-2-Oxo-Pyrimidin-3-Ium-1-Yl)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Nitrate

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Properties Simple | Detailed

Formula C9H12N4O7
IUPAC Name [(2r,3s,4r,5r)-2-(4-amino-2-oxo-pyrimidin-3-ium-1-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl] nitrate
Molecular Mass 288.214 g·mol−1
Heat of Formation -712.4 ± 16.7 kJ·mol−1
Dipole Moment 3.80 ± 1.08 D
Volume 300.05 Å 3
Surface Area 264.88 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
InChIKey GEOLFRUUPIBPPU-CCXZUQQUSA-O
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