6-Amino-1-(5-O-Phosphonopentofuranosyl)-2,4(1H,3H)-Pyrimidinedione

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Formula C9H14N3O9P
IUPAC Name [(2r,3s,4r,5r)-5-(6-amino-2,4-dioxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 339.196 g·mol−1
Heat of Formation -1890.7 ± 16.7 kJ·mol−1
Dipole Moment 6.41 ± 1.08 D
Volume 337.46 Å 3
Surface Area 296.78 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy -0.40 ± eV
Point Group Symmetry C1
InChIKey DUFXRFNPGXQQOI-YXZULKJRSA-P
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