[(2R,3S,4R,5R)-5-(5-Amino-4-Nitro-Imidazol-3-Ium-5-Id-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Formula C8H14N4O9P
IUPAC Name [(2r,3s,4r,5r)-5-(5-amino-4-nitro-imidazol-3-ium-5-id-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 341.192 g·mol−1
Heat of Formation -1439.2 ± 16.7 kJ·mol−1
Dipole Moment 10.34 ± 1.08 D
Volume 334.35 Å 3
Surface Area 301.89 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
InChIKey UIPCTMHJBQHRJC-AFCXAGJDSA-N
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