[(2R,3R,4R,5R)-4-(3-Aminopropoxy)-5-(2,4-Dioxopyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C12H20N3O9P
IUPAC Name [(2r,3r,4r,5r)-4-(3-aminopropoxy)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 381.276 g·mol−1
Heat of Formation -1847.0 ± 16.7 kJ·mol−1
Dipole Moment 5.01 ± 1.08 D
Volume 405.51 Å 3
Surface Area 360.91 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
InChIKey BYBLQLKEQYUZOM-QCNRFFRDSA-N
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