[(2R,3S,5S)-5-[(5R)-5-Fluoro-4-Imino-5-Methyl-2-Oxo-6-Thioxo-Hexahydropyrimidin-1-Yl]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C10H15FN3O7PS
IUPAC Name [(2r,3s,5s)-5-[(5r)-5-fluoro-4-imino-5-methyl-2-oxo-6-thioxo-hexahydropyrimidin-1-yl]-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 371.279 g·mol−1
Heat of Formation -1638.8 ± 16.7 kJ·mol−1
Dipole Moment 5.20 ± 1.08 D
Volume 369.55 Å 3
Surface Area 314.8 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy 1.20 ± eV
Point Group Symmetry C1
InChIKey YTBJQSMBUHMWBV-LKCKTBJASA-N
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