5-(Hydroxymethyl)Cytidine 5'-(Dihydrogen Phosphate)

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Formula C10H16N3O9P
IUPAC Name [(2r,3s,4r,5r)-5-[4-amino-5-(hydroxymethyl)-2-oxo-pyrimidin-1-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 353.223 g·mol−1
Heat of Formation -1848.0 ± 16.7 kJ·mol−1
Dipole Moment 9.05 ± 1.08 D
Volume 351.22 Å 3
Surface Area 308.3 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
InChIKey KPUOHXMVCZBWQC-JXOAFFINSA-N
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