[(3S,5R)-5-(4-Amino-5-Bromo-2-Oxo-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl [(2R,3S,5R)-5-(2-Amino-6-Oxo-3H-Purin-9-Yl)-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Hydrogen Phosphate

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Properties Simple | Detailed

Formula C19H24BrN8O10P
IUPAC Name [(2r,3s,5r)-5-(4-amino-5-bromo-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate
Molecular Mass 635.319 g·mol−1
Heat of Formation 1167.9 ± 16.7 kJ·mol−1
Dipole Moment 8.08 ± 1.08 D
Volume 575.33 Å 3
Surface Area 483.39 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy -4.61 ± eV
Point Group Symmetry C1
InChIKey HBRAXSCTBJJBAF-ASHHDVGLSA-N
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Elements P C O Br N