[(2S)-3-(5-Bromo-2,4-Dioxo-Pyrimidin-1-Yl)-2-Hydroxy-Propyl] Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C7H10BrN2O7P++
IUPAC Name [(2s)-3-(5-bromo-2,4-dioxo-pyrimidin-1-yl)-2-hydroxy-propyl] dihydrogen phosphate
Molecular Mass 345.041 g·mol−1
Heat of Formation -1537.6 ± 16.7 kJ·mol−1
Dipole Moment 1.98 ± 1.08 D
Volume 297.94 Å 3
Surface Area 264.29 Å 2
HOMO Energy -9.58 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry C1
InChIKey FBWWPOSBYNOMBJ-BYPYZUCNSA-N
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Elements C H O N P Br