[(2R,3S,5R)-5-(3,5-Dimethyl-2,4-Dioxo-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C11H17N2O8P++
IUPAC Name [(2r,3s,5r)-5-(3,5-dimethyl-2,4-dioxo-pyrimidin-1-ium-5-id-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 336.235 g·mol−1
Heat of Formation -1762.9 ± 16.7 kJ·mol−1
Dipole Moment 4.01 ± 1.08 D
Volume 353.52 Å 3
Surface Area 310.59 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
InChIKey NTZJWSXYZFTRBM-DJLDLDEBSA-P
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N